AG001F38

147688-62-8 | 4H-Pyran-4-one, tetrahydro-2-phenyl-

AG001F38

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CAS Number	147688-62-8
Catalog Number	AG001F38(AGN-PC-024TXZ)
Chemical Name	4H-Pyran-4-one, tetrahydro-2-phenyl-
IUPAC Name	2-phenyloxan-4-one
InChI	InChI=1S/C11H12O2/c12-10-6-7-13-11(8-10)9-4-2-1-3-5-9/h1-5,11H,6-8H2
InChI Key	WDYWHODSDKVYAL-UHFFFAOYSA-N
MDL Number	MFCD11112124
Molecular Formula	C11H12O2
Molecular Weight	176.2118
SMILES	C1(=CC=CC=C1)C2CC(CCO2)=O
Synonyms	2-phenyldihydro-2H-pyran-4(3H)-one, 147688-62-8, 2-phenyloxan-4-one, 2-phenyltetrahydro-4H-pyran-4-one, TETRAHYDRO-2-PHENYL-4H-PYRAN-4-ONE, 4H-Pyran-4-one,tetrahydro-2-phenyl-, 4H-Pyran-4-one, tetrahydro-2-phenyl-, (R)-2-Phenyldihydro-2H-pyran-4(3H)-one, PubChem16023, ACMC-209z3d, SCHEMBL4298893, 2-phenyl-tetrahydro-pyran-4-on, CTK4C5524, DTXSID70597033, WDYWHODSDKVYAL-UHFFFAOYSA-N, 82110-27-8, KS-00000N7L, ANW-49751, MFCD11112124, AKOS013421906, FS-3034, RP23791, AK-33344, BC684536, BR-33344, EN000600, AB0022372, ST2417157, TC-010148, 4CH-015304, FT-0660607, W3222, S-5546, 688P628, J-510258, I14-34408, 2-cyclopropylacetic acid, Fmoc-L-Tyr(2-Br-Z)-OH, C11H12O2,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	176.215g/mol
Monoisotopic Mass	176.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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