AG002Z4S

2969-81-5 | Butanoic acid, 4-bromo-, ethyl ester

AG002Z4S

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CAS Number	2969-81-5
Catalog Number	AG002Z4S(AGN-PC-0JLPXN)
Chemical Name	Butanoic acid, 4-bromo-, ethyl ester
EC Number	221-005-6
IUPAC Name	ethyl 4-bromobutanoate
InChI	InChI=1S/C6H11BrO2/c1-2-9-6(8)4-3-5-7/h2-5H2,1H3
InChI Key	XBPOBCXHALHJFP-UHFFFAOYSA-N
MDL Number	MFCD00000259
Molecular Formula	C6H11BrO2
Molecular Weight	195.0543
NSC Number	133462
SMILES	O=C(OCC)CCCBr
Synonyms	Ethyl 4-bromobutyrate, 2969-81-5, Ethyl 4-bromobutanoate, 4-Bromobutyric Acid Ethyl Ester, ETHYL-4-BROMOBUTYRATE, Butanoic acid, 4-bromo-, ethyl ester, MFCD00000259, ETHYL-4-BROMOTBUTYRATE, 4-BROMO-N-BUTYRIC ACID ETHYL ESTER, BrCH2CH2CH2C(O)OC2H5, 4-Bromo-butyric acid ethyl ester, XBPOBCXHALHJFP-UHFFFAOYSA-N, 4-BROMO-BUTANOIC ACID ETHYL ESTER, GAMMA-BROMOBUTYRIC ACID ETHYL ESTER, Ethyl 4-bromobutyrate, 97+%, EINECS 221-005-6, ethyl 4bromobutyrate, ethyl4-bromobutyrate, ethyl4-bromobutanoate, ethyl 4-bromobutanate, NSC 133462, PubChem3949, ethyl-4-bromobutanoate, ethyl 4- bromobutyrate, ethyl 4-bromo-butyrate, ethyl-4-bromo-butyrate, AI3-36601, Ethyl gamma-bromobutyrate, AC1L2QLZ, ethyl 4-bromo-n-butyrate, Ethyl 4-bromobutanoate #, ACMC-1CF2X, 4-Bromobutanoic acid ethyl, AC1Q27TY, AC1Q34RK, Ethyl .gamma.-bromobutyrate, 4-bromobutanoate ethyl ester, SCHEMBL85568, 1-bromo-3-carboethoxypropane, KSC206E1D, Ethyl 4-bromobutyrate, 95%, 3-(ethoxycarbonyl)propyl bromide, 4-bromobutanoic acid ethyl ester, CTK1A6211, XBPOBCXHALHJFP-UHFFFAOYSA-, DTXSID80183845, EBD2739, 4-Bromobutanoic acid, ethyl ester, STR05803, ZINC1720175, ANW-26688, NSC133462, SBB070757, AKOS005066835, AM84904, AS03591, CS-W020133, MCULE-5001503693, NSC-133462, RP25349, RTC-069756, TRA0000379, KS-000000A9, AJ-30980, AK-41609, BC002672, BP-12819, CJ-06863, CJ-29207, H277, SC-03228, AB0006059, DB-029752, ST2406950, TC-069756, B0999, FT-0083417, FT-0617879, FT-0626276, Butanoic acid, 4-bromo-, ethyl ester (9CI), 107938-EP2272817A1, 107938-EP2272848A1, 107938-EP2286811A1, 107938-EP2298746A1, I04-0300, ethyl 4-bromobutyrate;4-bromobutyric acid ethyl ester, F0001-0919, InChI=1/C6H11BrO2/c1-2-9-6(8)4-3-5-7/h2-5H2,1H3, Ethyl 2-bromobutanoate, Butanoic acid, ethyl ester, C6H11BrO2, C6-H11-Br-O2, ETHYL 4-BROMOBUTANOIC ACID, Ethyl 4-bromobutyrate, 98% 50g, CID76300, AR-1I9199, B-5800, Ethyl 4-bromobutyrate, 98% - 100ML 100ml, 3050-27-9,

Complexity	83.1
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	5
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number