AG003OKP

7398-42-7 | Methyl 2-(4-(bromomethyl)phenyl)acetate

AG003OKP

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CAS Number	7398-42-7
Catalog Number	AG003OKP(AGN-PC-00FTH9)
Chemical Name	Methyl 2-(4-(bromomethyl)phenyl)acetate
IUPAC Name	methyl 2-[4-(bromomethyl)phenyl]acetate
InChI	InChI=1S/C10H11BrO2/c1-13-10(12)6-8-2-4-9(7-11)5-3-8/h2-5H,6-7H2,1H3
InChI Key	APXOMRFLJBRHNX-UHFFFAOYSA-N
MDL Number	MFCD07783030
Molecular Formula	C10H11BrO2
Molecular Weight	243.0971
SMILES	O=C(OC)CC1=CC=C(CBr)C=C1
Synonyms	7398-42-7, Methyl 2-(4-(bromomethyl)phenyl)acetate, Methyl 4-(bromomethyl)phenylacetate, Benzeneacetic acid, 4-(bromomethyl)-, methyl ester, Methyl 2-[4-(bromomethyl)phenyl]acetate, (4-Bromomethyl-phenyl)-acetic acid methyl ester, Methyl [4-(bromomethyl)phenyl]acetate, AK122522, 4-[(Methoxycarbonyl)methyl]benzyl bromide, (4-Bromomethylphenyl)acetic acid methyl ester, methyl 4-(bromomethyl)phenyl acetate, SCHEMBL334884, methyl 4-bromomethylphenylacetate, CTK2H0728, KS-00000NSE, DTXSID30472231, APXOMRFLJBRHNX-UHFFFAOYSA-N, ACT10156, BCP24402, CS-M2747, ZX-AT006407, AM1171, methyl (4-bromomethyl-phenyl)acetate, methyl[4-(bromomethyl)phenyl]acetate, MFCD07783030, OR5099, ZINC16123999, AKOS015951139, AS06817, Methyl 2-(4-bromomethyl-phenyl)-acetate, AJ-68267, AS-18529, BC651001, CJ-15315, SY059274, 4-Bromomethylphenylacetic acid methyl ester, AB0007354, AB1008189, AX8091110, ST2419484, 4-bromomethylphenyl acetic acid methyl ester, 4CH-015693, FT-0616716, 4-(Bromomethyl)phenylacetic acid methyl ester, MFCD07783030 (95%), M-9410, 2-(4-(bromomethyl)phenyl)acetic acid methyl ester, 4-(BROMOMETHYL)-BENZENEACETIC ACID METHYL ESTER, null, Not Available, ACN-052884, CID11770640, Methyl2-(4-(bromomethyl)phenyl)acetate, 4-(Bromomethyl)phenylaceticacidphenacylester, 2-Oxo-2-phenylethyl 2-(4-(bromomethyl)phenyl)acetate,

Complexity	162
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	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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