AG001TFP

16281-97-3 | Benzoic acid, 4-(1-bromoethyl)-, methyl ester

AG001TFP

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	16281-97-3
Catalog Number	AG001TFP(AGN-PC-0NINV6)
Chemical Name	Benzoic acid, 4-(1-bromoethyl)-, methyl ester
IUPAC Name	methyl 4-(1-bromoethyl)benzoate
InChI	InChI=1S/C10H11BrO2/c1-7(11)8-3-5-9(6-4-8)10(12)13-2/h3-7H,1-2H3
InChI Key	IXZOUWPYWNKWCX-UHFFFAOYSA-N
MDL Number	MFCD18452043
Molecular Formula	C10H11BrO2
Molecular Weight	243.0971
SMILES	COC(=O)c1ccc(cc1)C(Br)C
Synonyms	Methyl 4-(1-bromoethyl)benzoate, 16281-97-3, Benzoic acid, 4-(1-bromoethyl)-, methyl ester, AK159832, 4-(1-bromo-ethyl)-benzoic acid methyl ester, 133446-40-9, SCHEMBL198552, CTK0E6191, KS-00000SIW, DTXSID20492140, IXZOUWPYWNKWCX-UHFFFAOYSA-N, methyl 4-(alpha-bromoethyl)benzoate, MFCD18452043, AKOS015969624, DS-9693, FCH1375806, methyl r,s-4-(1-bromoethyl)-benzoate, DA-45933, SC-92110, 4-(1-Bromoethyl)benzoic acid methyl ester, AX8293089, FT-0765338, ST24047867, ACN-046728,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.994g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	243.1g/mol
Monoisotopic Mass	241.994g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number