2-(p-Chlorophenyl)-3-methylbutyric Acid

Modify Date: 2025-08-27 11:18:22

2-(p-Chlorophenyl)-3-methylbutyric Acid structure	Common Name	2-(p-Chlorophenyl)-3-methylbutyric Acid
	CAS Number	2012-74-0	Molecular Weight	212.673
	Density	1.2±0.1 g/cm3	Boiling Point	318.7±17.0 °C at 760 mmHg
	Molecular Formula	C₁₁H₁₃ClO₂	Melting Point	87-91 °C(lit.)
	MSDS	Chinese USA	Flash Point	146.5±20.9 °C
	Symbol	GHS07	Signal Word	Warning

Name	2-(4-chlorophenyl)-3-methylbutyric acid
Synonym	More Synonyms

Density	1.2±0.1 g/cm3
Boiling Point	318.7±17.0 °C at 760 mmHg
Melting Point	87-91 °C(lit.)
Molecular Formula	C₁₁H₁₃ClO₂
Molecular Weight	212.673
Flash Point	146.5±20.9 °C
Exact Mass	212.060410
PSA	37.30000
LogP	3.33
Vapour Pressure	0.0±0.7 mmHg at 25°C
Index of Refraction	1.538
InChIKey	VTJMSIIXXKNIDJ-UHFFFAOYSA-N
SMILES	CC(C)C(C(=O)O)c1ccc(Cl)cc1

2-(p-Chlorophenyl)-3-methylbutyric Acid MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ES8450000

CHEMICAL NAME :: Butyric acid, 2-(p-chlorophenyl)-3-methyl-

CAS REGISTRY NUMBER :: 2012-74-0

LAST UPDATED :: 199710

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C11-H13-Cl-O2

MOLECULAR WEIGHT :: 212.69

WISWESSER LINE NOTATION :: QVYR DG&Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 26,954,1978

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 339 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 16,23,1961

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xi
Risk Phrases	R36/37/38
Safety Phrases	S26-S36
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	ES8450000
HS Code	2916399090

4-Chlorophenyla...

CAS#:1878-66-6

2-Chloropropane

CAS#:75-29-6

~89%

2-(p-Chlorophen...

CAS#:2012-74-0

Literature: Ihara Chemical Industry Co., Ltd. Patent: US4307034 A1, 1981 ;

fenvaleric aldehyde

CAS#:74408-48-3

~72%

2-(p-Chlorophen...

CAS#:2012-74-0

Literature: Luzzio, Frederick A.; Fitch, Richard W. Advanced Synthesis and Catalysis, 2000 , vol. 342, # 5 p. 498 - 501

2-(4-chlorophen...

CAS#:2012-81-9

~69%

2-(p-Chlorophen...

CAS#:2012-74-0

Literature: Volkov, Yu. P.; Kalinevich, V. M.; Trusova, E. I.; Bilevich, K. A.; Kryshtal', G. V.; Yanovskaya, L. Ya. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1986 , vol. 35, # 6 p. 1239 - 1242 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1986 , # 6 p. 1365 - 1368

4-Chlorobenzyl ...

CAS#:140-53-4

2-(p-Chlorophen...

CAS#:2012-74-0

Literature: Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), , vol. 35, # 6 p. 1239 - 1242 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , # 6 p. 1365 - 1368

4-Chlorotoluene

CAS#:106-43-4

2-(p-Chlorophen...

CAS#:2012-74-0

4-Chlorobenzyl ...

CAS#:622-95-7

2-(p-Chlorophen...

CAS#:2012-74-0

(S)-1-(3-Pyridy...

CAS#:5096-11-7

2-(4-Chlorpheny...

CAS#:51631-99-3

2-(p-Chlorophen...

CAS#:2012-74-0

N/A

CAS#:88549-73-9

Detail

Literature: Angewandte Chemie, , vol. 96, # 2 p. 166 - 167

(R)-(+)-1-(4-Py...

CAS#:27854-88-2

2-(4-Chlorpheny...

CAS#:51631-99-3

2-(p-Chlorophen...

CAS#:2012-74-0

N/A

CAS#:88549-71-7

Detail

Literature: Angewandte Chemie, , vol. 96, # 2 p. 166 - 167

fenvalerate

CAS#:51630-58-1

2-(p-Chlorophen...

CAS#:2012-74-0

alpha-Hydroxy-3...

CAS#:39515-47-4

Literature: Journal of Agricultural and Food Chemistry, , vol. 53, # 19 p. 7415 - 7420

Precursor 10
CAS#:1878-66-6 4-Chlorophenyla... CAS#:75-29-6 2-Chloropropane CAS#:74408-48-3 fenvaleric aldehyde CAS#:2012-81-9 2-(4-chlorophen...
CAS#:140-53-4 4-Chlorobenzyl ... CAS#:106-43-4 4-Chlorotoluene CAS#:622-95-7 4-Chlorobenzyl ... CAS#:5096-11-7 (S)-1-(3-Pyridy...
CAS#:51631-99-3 2-(4-Chlorpheny... CAS#:27854-88-2 (R)-(+)-1-(4-Py...
DownStream 5
CAS#:51630-58-1 fenvalerate CAS#:51631-50-6 2-(4-Chlorophen... CAS#:300851-67-6 4-CMTB CAS#:66230-04-4 Esfenvalerate
CAS#:67614-33-9 (R,R)-Fenvalerate

HS Code	2916399090
Summary	2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Name: Agonist activity at human FFA2 receptor expressed in CHO cells assessed as inhibition...
Source: ChEMBL
Target: Free fatty acid receptor 2
External Id: CHEMBL1069226

Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262

Name: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA

Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF

Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979

Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren

Name: Agonist activity at human FFA2 receptor expressed in CHO cells assessed as inhibition...
Source: ChEMBL
Target: Free fatty acid receptor 2
External Id: CHEMBL1069216

Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN

Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN

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2-(4-Chlorophenyl)-3-methylbutyric acid

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MFCD00037763

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2-(p-Chlorophenyl)-3-methylbutyric Acid

2-(4-Chlorophenyl)-3-methylbutanoic acid

fenvaleric acid

2-(P-CHLOROPHENYL)-3-METHYLBUTYRIC ACID---WHITE CRYSTALS

Alpha-Isopropyl-4-Chlorophenylacetic Acid

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EINECS 217-934-1

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China
Product Name: 2-(p-Chlorophenyl)-3-methylbutyric Acid
Price: ￥98.0/5g ￥288.0/25g
Purity: 98.0%
Delivery: 2 Day
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2-(p-Chlorophenyl)-3-methylbutyric Acid

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Safety Information

Synthetic Route

Precursor & DownStream

Customs

2-(p-Chlorophenyl)-3-methylbutyric AcidBioassay

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.