AG00D9X7

491-38-3 | 4H-1-Benzopyran-4-one

AG00D9X7

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CAS Number	491-38-3
Catalog Number	AG00D9X7(AGN-PC-0IK1SK)
Chemical Name	4H-1-Benzopyran-4-one
EC Number	207-737-9
IUPAC Name	chromen-4-one
InChI	InChI=1S/C9H6O2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H
InChI Key	OTAFHZMPRISVEM-UHFFFAOYSA-N
MDL Number	MFCD00024064
Molecular Formula	C9H6O2
Molecular Weight	146.1427
SMILES	O=C1C=COC2=CC=CC=C12
UNII	20C556MJ76
Synonyms	4-chromone, CHROMONE, 4H-Chromen-4-one, 491-38-3, 4H-1-Benzopyran-4-one, 4-Chromone, Benzo-gamma-pyrone, Chromen-4-one, 1-Benzopyran-4-one, 1,4-benzopyrone, 4H-Benzo(b)pyran-4-one, UNII-20C556MJ76, 4-oxo-4H-1-benzopyran, EINECS 207-737-9, BRN 0114087, CHEBI:72013, OTAFHZMPRISVEM-UHFFFAOYSA-N, 1-BENZOPYRAN-4(4H)-ONE, 20C556MJ76, AF-407/03086014, 4-chromenone, Benz-g-pyrone, benzopyran-4-one, chromone, 12, Chromone, 99%, Benzo-.gamma.-pyrone, ACMC-20air4, 3-dihydrochromen-4-one, 4H-Chromen-4-one #, AC1L1UVQ, SCHEMBL37994, 5-17-10-00139 (Beilstein Handbook Reference), MLS002473394, CHEMBL13311, FC13, SCHEMBL7566748, BDBM24783, CTK1D6852, KS-00000KLH, ZINC57736, DTXSID40197680, ZX-AT021198, ACM491383, ANW-75230, MFCD00024064, SBB086467, AKOS000521772, ACN-049175, CS-W005942, FCH1117146, GS-6824, MCULE-8366757644, OR22414, VZ31581, AJ-09783, AK-26021, CC-25765, LS-53467, SC-62346, SMR001397486, ST092368, ZB002246, AB1002817, AX8033773, DB-050521, DB-051603, FT-0632217, V6166, A-8057, 90697-EP2292593A2, 90697-EP2305640A2, A827660, C-02437, I14-52826, InChI=1/C9H6O2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6, Benzopyrone, Chroman-4-one, 4-Chromanone, 4H-benzo[b]pyran-4-one, C9H6O2, C9-H6-O2, CID10286, A7362, C068515, 491-37-2, 15485-80-0, 15773-96-3,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.037g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	146.145g/mol
Monoisotopic Mass	146.037g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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