AG00728Y

42436-86-2 | Cyclobutanone, 2-phenyl-

AG00728Y

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CAS Number	42436-86-2
Catalog Number	AG00728Y(AGN-PC-0WA72J)
Chemical Name	Cyclobutanone, 2-phenyl-
IUPAC Name	2-phenylcyclobutan-1-one
InChI	InChI=1S/C10H10O/c11-10-7-6-9(10)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChI Key	BJFZFQHWYGJPQD-UHFFFAOYSA-N
MDL Number	MFCD19382274
Molecular Formula	C10H10O
Molecular Weight	146.1858
SMILES	O=C1CCC1C1=CC=CC=C1
Synonyms	2-phenylcyclobutanone, 2-phenylcyclobutan-1-one, 42436-86-2, Cyclobutanone, 2-phenyl-, 2-phenyl-cyclobutan-1-one, SCHEMBL13210441, CTK1D3200, DTXSID90466792, MFCD19382274, AKOS022179919, NE25557, SB10969, KS-0000047F, AS-42272, CS-0051808, EN300-80618, F8880-8488, CID11469141,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.073g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	146.189g/mol
Monoisotopic Mass	146.073g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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