AG00356X

69026-10-4 | methyl 3-formyl-5-methoxybenzoate

AG00356X

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CAS Number	69026-10-4
Catalog Number	AG00356X(AGN-PC-006IIK)
Chemical Name	methyl 3-formyl-5-methoxybenzoate
IUPAC Name	methyl 3-formyl-5-methoxybenzoate
InChI	InChI=1S/C10H10O4/c1-13-9-4-7(6-11)3-8(5-9)10(12)14-2/h3-6H,1-2H3
InChI Key	WFYPMONPCUQCRM-UHFFFAOYSA-N
MDL Number	MFCD11045770
Molecular Formula	C10H10O4
Molecular Weight	194.1840
SMILES	C(=O)C=1C=C(C(=O)OC)C=C(C1)OC
Synonyms	METHYL 3-FORMYL-5-METHOXYBENZOATE, 69026-10-4, SCHEMBL3507331, methyl 5-formyl-3-methoxybenzoate, WFYPMONPCUQCRM-UHFFFAOYSA-N, 7033AJ, MFCD11045770, ZINC95760877, AKOS005216586, AB62980, TRA0076068, KS-00000B32, METHYL3-FORMYL-5-METHOXYBENZOATE, AS-32408, CJ-22746, SY025806, DB-074094, 3-Methoxy-5-formylbenzoic acid methyl ester, Z-3626, MFCD11045770 (97+%), C10H10O4, Methyl 3-formyl-5-methoxy-benzoate, CID11310067,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405-P501
UN Code

Certificate of Analysis

Lot Number