AG003ISP

779-30-6 | N-(2-Oxo-2H-chromen-3-yl)acetamide

AG003ISP

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CAS Number	779-30-6
Catalog Number	AG003ISP(AGN-PC-0JMOZ9)
Chemical Name	N-(2-Oxo-2H-chromen-3-yl)acetamide
IUPAC Name	N-(2-oxochromen-3-yl)acetamide
InChI	InChI=1S/C11H9NO3/c1-7(13)12-9-6-8-4-2-3-5-10(8)15-11(9)14/h2-6H,1H3,(H,12,13)
InChI Key	XJYLCCJIDYSFMB-UHFFFAOYSA-N
MDL Number	MFCD00075556
Molecular Formula	C11H9NO3
Molecular Weight	203.1941
NSC Number	65873
SMILES	O=C1OC2=C(C=CC=C2)C=C1NC(C)=O
Synonyms	3-Acetamidocoumarin, 779-30-6, N-(2-Oxo-2H-chromen-3-yl)acetamide, 3-acetamido-coumarin, 3-Acetylaminocoumarin, 3-(Acetylamino)coumarin, N-(2-oxochromen-3-yl)acetamide, N1-(2-oxo-2H-chromen-3-yl)acetamide, A1-01398, SR-01000389251, NSC65873, PubChem8662, Maybridge1_000258, Prestwick0_000969, Prestwick1_000969, Prestwick2_000969, Prestwick3_000969, ChemDiv2_000143, AC1Q1L2N, Oprea1_480692, BSPBio_000977, CBDivE_000070, MLS000719859, CHEMBL63349, SCHEMBL893303, SPBio_002898, AC1L38X7, BPBio1_001075, CHEBI:95324, CTK5E5200, HMS542D16, ZINC67488, DTXSID80228528, XJYLCCJIDYSFMB-UHFFFAOYSA-N, HMS1369G11, HMS1571A19, HMS2098A19, HMS2616G21, BCP20917, BTB 01088, CCG-15095, MFCD00075556, NSC 65873, NSC-65873, AKOS005202961, MCULE-8239666346, TRA0010184, VZ26206, N-(2-oxo-1-benzopyran-3-yl)acetamide, NCGC00016539-01, NCGC00016539-02, NCGC00179352-01, CAS-779-30-6, CC-13900, N-(2-Oxo-2H-chromen-3-yl)acetamide #, OR345139, SMR000304388, ZB002570, N-(2-oxidanylidenechromen-3-yl)ethanamide, DB-022150, N-(2-Oxo-2H-1-benzopyran-3-yl)acetamide, A2972, AB00513981, FT-0614856, ST50319576, Acetamide,N-(2-oxo-2H-1-benzopyran-3-yl)-, A839295, C-09857, SR-01000389251-1, SR-01000389251-2, SR-01000389251-4, BRD-K85104575-001-03-2, BRD-K85104575-001-07-3, InChI=1/C11H9NO3/c1-7(13)12-9-6-8-4-2-3-5-10(8)15-11(9)14/h2-6H,1H3,(H,12,13, CID136620, ACN-055679,

Complexity	322
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	203.197g/mol
Monoisotopic Mass	203.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55.4A^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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