AG003367

533-68-6 | Ethyl 2-bromobutanoate

AG003367

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CAS Number	533-68-6
Catalog Number	AG003367(AGN-PC-0JLRR5)
Chemical Name	Ethyl 2-bromobutanoate
EC Number	208-574-6
IUPAC Name	ethyl 2-bromobutanoate
InChI	InChI=1S/C6H11BrO2/c1-3-5(7)6(8)9-4-2/h5H,3-4H2,1-2H3
InChI Key	XIMFCGSNSKXPBO-UHFFFAOYSA-N
MDL Number	MFCD00000155
Molecular Formula	C6H11BrO2
Molecular Weight	195.0543
NSC Number	8855
SMILES	BrC(C(=O)OCC)CC
Synonyms	Ethyl 2-bromobutanoate, Ethyl 2-bromobutyrate, 533-68-6, DL-Ethyl 2-bromobutyrate, 2-Bromobutanoic acid ethyl ester, Butanoic acid, 2-bromo-, ethyl ester, 2-Bromobutyric Acid Ethyl Ester, NSC 8855, Ethyl .alpha.-bromobutyrate, 2-bromo-butyric acid ethyl ester, XIMFCGSNSKXPBO-UHFFFAOYSA-N, MFCD00000155, Butyric acid, 2-bromo-, ethyl ester, 2-Bromo-Butanoicaciethylester, ethyl-2-bromobutyrate, Ethyl alpha-bromobutyrate, ethyl bromobutyrate, ethyl bromobutanoate, EINECS 208-574-6, Ethyl2-Bromobutyrate, ethyl 2-bromo-butyrate, AI3-52371, AC1L2WIP, ethyl 2-bromo-n-butyrate, ACMC-209l6i, EC 208-574-6, bromobutyric acid ethyl ester, ethyl (RS)-2-bromobutyrate, ETHYL beta-BROMOBUTYRATE, KSC490A4F, Ethyl 2-bromobutyrate, 99%, SCHEMBL189345, bromo-butyric acid ethyl ester, AC1Q245I, AC1Q31Z1, Ethyl .alpha.-bromo-n-butyrate, CTK3J0042, KS-00000BCP, NSC8855, 2-bromo-butanoic acid ethyl ester, NSC-8855, STR03819, 7493AF, ANW-31720, SBB070758, .alpha.-Bromobutyric acid ethyl ester, AKOS000121219, AKOS017278407, MCULE-2467634064, RP25347, RTR-018876, TRA0039099, .alpha.-Bromo-n-butyric acid ethyl ester, AK162998, AN-24883, DB-029736, TR-018876, B0800, FT-0626264, ST24046847, Butyric acid, 2-bromo-, ethyl ester (8CI), A22906, I14-6077, J-520413, F2190-0280, 2-Bromobutanoic acid ethyl ester;alpha-Bromo-n-butyric acid ethyl ester, UNII-SB2GD08LJA, C6H11BrO2, Butyric acid, ethyl ester, SB2GD08LJA, Butanoic acid, ethyl ester, C6-H11-Br-O2, CID79039, AR-1I8330, Ethyl 2-bromobutyrate, 97% 100g, Ethyl 2-bromobutyrate, 97% - 100G 100g, 67992-12-5,

Complexity	93.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.994g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	195.056g/mol
Monoisotopic Mass	193.994g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P302+P352-P305+P351+P338-P321-P405-P501
UN Code	UN 1993

Certificate of Analysis

Lot Number