AG00155Q

1215205-50-7 | Cyclopropanecarboxylic acid, 1-(4-bromophenyl)-, ethyl ester

AG00155Q

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CAS Number	1215205-50-7
Catalog Number	AG00155Q(AGN-PC-0WACZU)
Chemical Name	Cyclopropanecarboxylic acid, 1-(4-bromophenyl)-, ethyl ester
IUPAC Name	ethyl 1-(4-bromophenyl)cyclopropane-1-carboxylate
InChI	InChI=1S/C12H13BrO2/c1-2-15-11(14)12(7-8-12)9-3-5-10(13)6-4-9/h3-6H,2,7-8H2,1H3
InChI Key	KCCISTCYYRKGFF-UHFFFAOYSA-N
MDL Number	MFCD15143548
Molecular Formula	C12H13BrO2
Molecular Weight	269.1344
SMILES	O=C(C1(C2=CC=C(Br)C=C2)CC1)OCC
Synonyms	ETHYL 1-(4-BROMOPHENYL)CYCLOPROPANECARBOXYLATE, 1215205-50-7, 1-(4-Bromo-phenyl)-cyclopropanecarboxylic acid ethyl ester, ETHYL1-(4-BROMOPHENYL)CYCLOPROPANECARBOXYLATE, ACMC-209abx, SCHEMBL1510, ethyl 1-(4-bromophenyl)cyclopropane-1-carboxylate, CTK4B2420, DTXSID80681972, KCCISTCYYRKGFF-UHFFFAOYSA-N, ANW-17659, ZINC65337075, AKOS015843290, ACN-037326, DS-3591, AK107037, DA-17035, SC-97492, SY036422, AJ-114991, ST2406834, TX-012351, 4CH-017785, CS-0041274, FT-0709023, Z8358, MFCD15143548 (95%), A-5444, I14-24846, Cyclopropanecarboxylic acid, 1-(4-bromophenyl)-, ethyl ester, C12H13BrO2,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.01g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	269.138g/mol
Monoisotopic Mass	268.01g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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