AG0028FI

20280-81-3 | 2H-1-Benzopyran-2-one, 4-methoxy-

AG0028FI

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CAS Number	20280-81-3
Catalog Number	AG0028FI(AGN-PC-0JSERV)
Chemical Name	2H-1-Benzopyran-2-one, 4-methoxy-
IUPAC Name	4-methoxychromen-2-one
InChI	InChI=1S/C10H8O3/c1-12-9-6-10(11)13-8-5-3-2-4-7(8)9/h2-6H,1H3
InChI Key	MLCMXDYMSAZNPC-UHFFFAOYSA-N
MDL Number	MFCD00017349
Molecular Formula	C10H8O3
Molecular Weight	176.1687
SMILES	O=C1OC2=C(C=CC=C2)C(OC)=C1
Synonyms	4-Methoxycoumarin, 20280-81-3, 4-methoxy-2H-chromen-2-one, 4-Methoxycoumarine, 4-Methoxycourmarin, 4-methoxychromen-2-one, 2H-1-Benzopyran-2-one, 4-methoxy-, MFCD00017349, MLCMXDYMSAZNPC-UHFFFAOYSA-N, 2H-1-Benzopyran-2-one,4-methoxy-, 4-methoxy-2h-chromen-2-on, 4 - Methoxycoumarin, ACMC-20amex, Coumarin, 4-methoxy-, Maybridge3_005843, 4-Methoxy-chromen-2-one, AC1LB58F, AC1Q69XC, MLS004491720, CHEMBL452360, SCHEMBL1627582, 4-Hydroxycoumarin, methyl ether, CTK4E3747, ZINC57913, DTXSID20174136, HMS1447J13, ZX-AT028170, STL371134, 2(1H)-Benzopyran-2-one, 4-methoxy, AKOS025247530, FCH1114447, MCULE-3313653961, ACM20280813, IDI1_017230, SMR003288678, ZB002267, DB-045148, TC-168720, CS-0063208, FT-0618940, ST50308982, C-57731, I14-94393, 2-Methyl-5-phenyl-N-[4-(4-pyridinylmethyl)phenyl]-3-furamide, AR-1G3058, C10-H8-O3, CID529426, ZINC00057913, Furane-3-carboxamide, 2-methyl-5-phenyl-N-[4-(4-pyridylmethyl)phenyl]-, 20364-09-4,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.047g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	176.171g/mol
Monoisotopic Mass	176.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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