1-Methyl-5-Nitroindole

Modify Date: 2025-09-01 17:35:00

1-Methyl-5-Nitroindole Structure
1-Methyl-5-Nitroindole structure
Common Name 1-Methyl-5-Nitroindole
CAS Number 29906-67-0 Molecular Weight 195.215
Density 1.2±0.1 g/cm3 Boiling Point 330.0±27.0 °C at 760 mmHg
Molecular Formula C10H13NO3 Melting Point 167ºC
MSDS N/A Flash Point 153.4±23.7 °C

 Names

Name 1-methyl-5-nitroindole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 330.0±27.0 °C at 760 mmHg
Melting Point 167ºC
Molecular Formula C10H13NO3
Molecular Weight 195.215
Flash Point 153.4±23.7 °C
Exact Mass 195.089539
PSA 50.75000
LogP 0.53
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.561

 MSDS

Material Safety Data Sheet

Section1. Identification of the substance
Product Name: 1-Methyl-5-nitro-1h-indole
Synonyms:

Section2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.

Section3. Composition/information on ingredients.
Ingredient name:1-Methyl-5-nitro-1h-indole
CAS number:29906-67-0

Section4. First aid measures
Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing
contaminated clothing and shoes. If irritation persists, seek medical attention.
Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
attention.
Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section5. Fire fighting measures
In the event of a fire involving this material, alone or in combination with other materials, use dry
powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
should be worn.

Section6. Accidental release measures
Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
standards.
Respiratory precaution:Wear approved mask/respirator
Hand precaution:Wear suitable gloves/gauntlets
Skin protection:Wear suitable protective clothing
Eye protection:Wear suitable eye protection
Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
for disposal. See section 12.
Environmental precautions: Do not allow material to enter drains or water courses.

Section7. Handling and storage
Handling:This product should be handled only by, or under the close supervision of, those properly qualified
in the handling and use of potentially hazardous chemicals, who should take into account the fire,
health and chemical hazard data given on this sheet.
Store in closed vessels, refrigerated.
Storage:

Section8. Exposure Controls / Personal protection
Engineering Controls: Use only in a chemical fume hood.
Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section9. Physical and chemical properties
Appearance:Not specified
Boiling point:No data
No data
Melting point:
Flash point:No data
Density:No data
Molecular formula:C9H8N2O2
Molecular weight:176.2

Section10. Stability and reactivity
Conditions to avoid: Heat, flames and sparks.
Materials to avoid: Oxidizing agents.
Possible hazardous combustion products: Carbon monoxide, nitrogen oxides.

Section11. Toxicological information
No data.

Section12. Ecological information
No data.

Section13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section14. Transportation information
Non-harzardous for air and ground transportation.

Section15. Regulatory information
No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
Title III, Section 313.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi
HS Code 2933990090

 Synthetic Route

~%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: WO2006/40520 A1, ; Page/Page column 124-125 ; WO 2006/040520 A1

~99%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: The United States of America, as represented by the Secretary, Department of Health and Human Services; Science Applications International Corporation (SAIC); Albany Molecular Research, Inc. Patent: WO2009/42907 A1, 2009 ; Location in patent: Page/Page column 36 ; WO 2009/042907 A1

~96%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: Hoffmann-La Roche Inc. Patent: US6326501 B1, 2001 ;

~97%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: Jiang, Xinglong; Tiwari, Ashish; Thompson, Maethonia; Chen, Zhihong; Cleary, Thomas P.; Lee, Thomas B. K. Organic Process Research and Development, 2001 , vol. 5, # 6 p. 604 - 608

~99%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: Goverdhan, Gilla; Reddy, Anumula Raghupathi; Sampath, Aalla; Srinivas, Kurella; Himabindu, Vurimidi; Reddy, Ghanta Mahesh Organic Process Research and Development, 2009 , vol. 13, # 1 p. 67 - 72

~92%

1-Methyl-5-Nitroindole Structure

1-Methyl-5-Nitr...

CAS#:29906-67-0

Literature: Gurkan, A. Selen; Karabay, Arzu; Buyukbingol, Zeliha; Adejare, Adeboye; Buyukbingol, Erdem Archiv der Pharmazie, 2005 , vol. 338, # 2-3 p. 67 - 73

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

5-nitro-N-methylindole
L-TYROSINE, METHYL ESTER
MFCD07772841
5-nitro-1-methylindole
Tyr-OMe
Tyrosine, methyl ester
Tyrosine, methyl ester, L-
L-tyrosine methyl ester HCl salt
l-tyrosine methyl ester
D,L-tyrosine methyl ester
Tyrosine,methyl ester
Methyl tyrosinate
Methyl L-tyrosinate
methylnitroindole
L-Tyrosine,methyl ester
1-Methyl-5-nitro-1H-indole
H-Tyr-OMe
1H-Indole, 1-methyl-5-nitro-
D,L-Tyr-OMe
1-methyl-5-nitro-indole
1-Methyl-5-Nitroindole
methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate
N-methyl-5-nitroindole
Tyrosine methyl ester
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