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Methyl 4-bromocrotonate

Catalog Number ACM6000006-1
CAS 6000-00-6
Structure {[CurrentData.Name]}
IUPAC Name methyl (E)-4-bromobut-2-enoate
Synonyms Methyl 4-bromocrotonate;1117-71-1;(E)-Methyl 4-bromobut-2-enoate;6000-00-6;4-Bromocrotonic Acid Methyl Ester;Methyl bromocrotonate;Methyl gamma-bromocrotonate;methyl (E)-4-bromobut-2-enoate;Methyl 4-bromo-2-butenoate;methyl (2E)-4-bromobut-2-enoate;CROTONIC ACID, 4-BROMO-, METHYL ESTER;MFCD00000246;methyl4-bromocrotonate;Methyl .gamma.-bromocrotonate;Methyl trans-4-bromocrotonate;methyl (E)-4-bromo-2-butenoate;Methyl trans-4-bromo-2-butenoate;2-Butenoic acid, 4-bromo-, methyl ester, (2E)-;4-Bromo-2-butenoic acid methyl ester;trans-4-Bromo-2-butenoic Acid Methyl Ester;APAC 565542;methyl-4-bromcrotonat;Methyl 4-bromocrotonate, 85%, tech.;methyl-4-bromocrotonate;EINECS 214-251-0;NSC 77073;BRN 1745755;Methyl 4-bromocrotonate, tech grade;zlchem 231;methyl 4-bromocrotoriate;methyl 4-bromo-crotonate;SCHEMBL25768;SCHEMBL25769;WLN: E2U1VO1;Methyl 4-bromocrotonate, tech.;4-Bromo-2-butenoic acid methyl;CHEMBL3273389;RWIKCBHOVNDESJ-NSCUHMNNSA-;ZLC0039;ACT03067;AMY14793;BCP09298;EBD53385;Methyl-(2E)-4-bromobut-2-enoate;NSC77073;ZINC1708353;methyl (E)-4-bromanylbut-2-enoate;BBL011112;MFCD09998308;NSC-77073;SBB070730;STK802365;AKOS005622672;CS-W008761;(E)-4-Bromo-2-butenoic acid methylester;AS-17533;BC005215;BC005256;BP-20396;(E)-4-bromo-2-butenoic acid methyl ester;DB-008633;(e)-4-bromo-but-2-enoic acid methyl ester;M1689;V0603;M-7513;Methyl 4-bromocrotonate, 85%, technical grade;A802410;W-108668;F0001-0253;Methyl trans-4-bromo-2-butenoate, technical, >=90% (GC)
Molecular Weight 179.01g/mol
Molecular Formula C5H7BrO2
Canonical SMILES COC(=O)C=CCBr
InChI InChI=1S/C5H7BrO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3/b3-2+
InChI Key RWIKCBHOVNDESJ-NSCUHMNNSA-N
Complexity 98.6
Covalently-Bonded Unit Count 1
EC Number 214-251-0
Exact Mass 177.96294g/mol
Heavy Atom Count 8
Hydrogen Bond Acceptor Count 2
Monoisotopic Mass 177.96294g/mol
NSC Number 77073
Rotatable Bond Count 3
Topological Polar Surface Area 26.3Ų
X Log P3 1.1
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