AG0059P6

74733-25-8 | Methyl 3-fluoro-4-formylbenzoate

AG0059P6

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CAS Number	74733-25-8
Catalog Number	AG0059P6(AGN-PC-0215HY)
Chemical Name	Methyl 3-fluoro-4-formylbenzoate
IUPAC Name	methyl 3-fluoro-4-formylbenzoate
InChI	InChI=1S/C9H7FO3/c1-13-9(12)6-2-3-7(5-11)8(10)4-6/h2-5H,1H3
InChI Key	GJYBURAJRAHKAW-UHFFFAOYSA-N
MDL Number	MFCD16036860
Molecular Formula	C9H7FO3
Molecular Weight	182.1485
SMILES	COC(=O)C1=CC(F)=C(C=O)C=C1
Synonyms	METHYL 3-FLUORO-4-FORMYLBENZOATE, 74733-25-8, 3-fluoro-4-formylbenzoic acid methyl ester, Benzoic acid, 3-fluoro-4-formyl-, methyl ester, MFCD16036860, SCHEMBL1765681, CTK8C4359, KS-00000PJY, DTXSID50596105, GJYBURAJRAHKAW-UHFFFAOYSA-N, BCP27816, ANW-71656, CL9165, ZINC77020731, AKOS016007363, CS-W018604, AK-77093, CJ-21894, DS-16973, QC-10891, AB0058368, AJ-122365, TC-160401, 3-Fluoro-4-formyl benzoic acid methyl ester, 3-fluoro-4-formyl-benzoic acid methyl ester, 4CH-011236, ST24025296, Z5096, M-8855, C9H7FO3, Methyl3-fluoro-4-formylbenzoate,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.038g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	182.15g/mol
Monoisotopic Mass	182.038g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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

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