2-Chloro-6-fluoro-3-methylbenzaldehyde

Modify Date: 2026-07-19 11:16:42

2-Chloro-6-fluoro-3-methylbenzaldehyde Structure
2-Chloro-6-fluoro-3-methylbenzaldehyde structure
Common Name 2-Chloro-6-fluoro-3-methylbenzaldehyde
CAS Number 104451-99-2 Molecular Weight 172.58400
Density 1.292 g/cm3 Boiling Point 225.1ºC at 760 mmHg
Molecular Formula C8H6ClFO Melting Point 30-33 °C(lit.)
MSDS N/A Flash Point 230 °F

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 2-Chloro-6-fluoro-3-methylbenzaldehyde
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.292 g/cm3
Boiling Point 225.1ºC at 760 mmHg
Melting Point 30-33 °C(lit.)
Molecular Formula C8H6ClFO
Molecular Weight 172.58400
Flash Point 230 °F
Exact Mass 172.00900
PSA 17.07000
LogP 2.60000
Vapour Pressure 0.0882mmHg at 25°C
Index of Refraction 1.552
InChIKey CSYKEPRGLYWJCW-UHFFFAOYSA-N
SMILES Cc1ccc(F)c(C=O)c1Cl

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

Name: 2-Chloro-6-fluoro-3-methylbenzaldehyde Material Safety Data Sheet
Synonym: 2-Chloro-6-fluoro-m-tolualdehyd
CAS: 104451-99-2
Section 1 - Chemical Product MSDS Name:2-Chloro-6-fluoro-3-methylbenzaldehyde Material Safety Data Sheet
Synonym:2-Chloro-6-fluoro-m-tolualdehyd

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
104451-99-2 2-Chloro-6-fluoro-3-methylbenzaldehyde unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:
Treat symptomatically and supportively.

Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Store under an inert atmosphere.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 104451-99-2: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 30 - 33 deg C
Autoignition Temperature: Not available.
Flash Point: 110 deg C ( 230.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C8H6ClFO
Molecular Weight: 172.59

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures. Air sensitive.
Conditions to Avoid:
Incompatible materials, exposure to air.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, carbon dioxide, hydrogen fluoride gas.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 104451-99-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-Chloro-6-fluoro-3-methylbenzaldehyde - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION


Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 104451-99-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 104451-99-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 104451-99-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases S26-S36
WGK Germany 3
HS Code 2913000090

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2913000090
Summary HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

MFCD01631360
2-chloro-6-fluoro-3-methylbenzaldehyde

 2-Chloro-6-fluoro-3-methylbenzaldehyde | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the molecular formula of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: Molecular formula of 2-Chloro-6-fluoro-3-methylbenzaldehyde is C8H6ClFO.
Q: What is the SMILES notation of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: SMILES notation of 2-Chloro-6-fluoro-3-methylbenzaldehyde is Cc1ccc(F)c(C=O)c1Cl.
Q: What is the LogP of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: LogP of 2-Chloro-6-fluoro-3-methylbenzaldehyde is 2.60000.
Q: What is the English name of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: The English name of 2-Chloro-6-fluoro-3-methylbenzaldehyde is 2-Chloro-6-fluoro-3-methylbenzaldehyde.
Q: What English synonyms does 2-Chloro-6-fluoro-3-methylbenzaldehyde have?
A: English synonyms of 2-Chloro-6-fluoro-3-methylbenzaldehyde: MFCD01631360, 2-chloro-6-fluoro-3-methylbenzaldehyde.
Q: What is the InChIKey of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: InChIKey of 2-Chloro-6-fluoro-3-methylbenzaldehyde is CSYKEPRGLYWJCW-UHFFFAOYSA-N.
Q: What is the polar surface area (PSA) of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: Polar surface area (PSA) of 2-Chloro-6-fluoro-3-methylbenzaldehyde is 17.07000.
Q: What is the CAS number of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: CAS number of 2-Chloro-6-fluoro-3-methylbenzaldehyde is 104451-99-2.
Q: What is the safety information for 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: Safety information for 2-Chloro-6-fluoro-3-methylbenzaldehyde: S26-S36.
Q: What is the melting point of 2-Chloro-6-fluoro-3-methylbenzaldehyde?
A: Melting point of 2-Chloro-6-fluoro-3-methylbenzaldehyde is 30-33 °C(lit.).

 2-Chloro-6-fluoro-3-methylbenzaldehydefactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
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