AG00BXNF

35450-37-4 | METHYL 3-BROMO-4-METHOXYBENZOATE 98

AG00BXNF

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CAS Number	35450-37-4
Catalog Number	AG00BXNF(AGN-PC-0JTRWU)
Chemical Name	METHYL 3-BROMO-4-METHOXYBENZOATE 98
IUPAC Name	methyl 3-bromo-4-methoxybenzoate
InChI	InChI=1S/C9H9BrO3/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5H,1-2H3
InChI Key	ZREVPFANJBZHEU-UHFFFAOYSA-N
MDL Number	MFCD00210463
Molecular Formula	C9H9BrO3
Molecular Weight	245.0700
SMILES	O=C(OC)C1=CC=C(OC)C(Br)=C1
Synonyms	Methyl 3-bromo-4-methoxybenzoate, 35450-37-4, 3-Bromo-4-methoxybenzoic acid methyl ester, Methyl3-bromo-4-methoxybenzoate, ZREVPFANJBZHEU-UHFFFAOYSA-N, Benzoic acid, 3-bromo-4-methoxy-, methyl ester, MFCD00210463, ACMC-209igx, AC1LD3YO, Methyl 3-Bromo-p-anisate, TimTec1_002998, SCHEMBL36283, ARONIS001013, RARECHEM AL BF 0247, CTK4H4569, KS-00003UKS, ZINC88362, DTXSID80346377, methyl-3-bromo-4-methoxybenzoate, HMS1542I06, ACT12154, AKOS 212-63, 3-Bromo-p-anisic Acid Methyl Ester, Methyl 3-bromo-4-methoxybenzoate #, ANW-28207, SBB067797, STK089089, TD1256, AKOS000276890, Methyl 3-bromo-4-(methyloxy)benzoate, AS03638, CM-1638, MCULE-6939391788, TRA0063902, Methyl 3-bromo-4-methoxybenzoate, 98%, AC-26010, AJ-10804, CJ-00707, ST039797, AB0068330, AB1008168, DB-014045, TC-067210, 3-Bromo-4-methoxy-benzoic acid methyl ester, 4CH-000831, C3351, FT-0653905, M2264, ST24047810, V5447, METHYL 3-BROMO-4-METHOXYBENZOATE 98, A20192, Benzoic acid,3-bromo-4-methoxy-, methyl ester, S-0206, AN-329/41128284, I14-5169, BRD-K60147618-001-01-3, C9H9BrO3, CID611662, ZINC00088362, ACN-051411, METHYL3-BROMO-4-METHOXYBENZOATE98,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.974g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	245.072g/mol
Monoisotopic Mass	243.974g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number