AG003JAM

Name: 3-chlorobutanoic acid
Brand: Angene Chemical
SKU: AG003JAM

1951-12-8 | 3-chlorobutanoic acid

AG003JAM

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CAS Number	1951-12-8
Catalog Number	AG003JAM(AGN-PC-0JKCNH)
Chemical Name	3-chlorobutanoic acid
EC Number	217-771-6
IUPAC Name	3-chlorobutanoic acid
InChI	InChI=1S/C4H7ClO2/c1-3(5)2-4(6)7/h3H,2H2,1H3,(H,6,7)
InChI Key	XEEMVPPCXNTVNP-UHFFFAOYSA-N
MDL Number	MFCD00020496
Molecular Formula	C4H7ClO2
Molecular Weight	122.5502
NSC Number	404459
SMILES	ClC(CC(=O)O)C
Synonyms	3-CHLOROBUTYRIC ACID, 3-Chlorobutanoic acid, Butanoic acid, 3-chloro-, 1951-12-8, Butyric acid, 3-chloro-, beta-Chlorobutyric acid, 3-chloro-n-butyric acid, .beta.-Chlorobutyric acid, EINECS 217-771-6, NSC 404459, BRN 1720571, ss-Chlorbuttersaure, 1-Pyrenebutyric hydrazide, 3-CHLOROBUTYRICACID, AC1Q2B0K, WLN: QV1YG1, SCHEMBL158448, AC1L275L, ACMC-1C001, CTK8A8928, XEEMVPPCXNTVNP-UHFFFAOYSA-N, 7238AF, ANW-13566, MFCD00020496, NSC404459, AKOS009028977, MCULE-1436146199, NSC-404459, LS-47896, TC-102310, FT-0694617, 4-02-00-00823 (Beilstein Handbook Reference), I14-91686, 625-68-3, C4H7ClO2, 3-Chloro-n-butyric acid; >95%, CID16048, c0147, 55486-13-0,

Complexity	72.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	122.013g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	122.548g/mol
Monoisotopic Mass	122.013g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited