AG00EDRJ

Name: (S)-3-Phenylcyclohexanone
Brand: Angene Chemical
SKU: AG00EDRJ

57344-86-2 | (S)-3-Phenylcyclohexanone

AG00EDRJ

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CAS Number	57344-86-2
Catalog Number	AG00EDRJ(AGN-PC-0OCJ8G)
Chemical Name	(S)-3-Phenylcyclohexanone
IUPAC Name	(3S)-3-phenylcyclohexan-1-one
InChI	InChI=1S/C12H14O/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2/t11-/m0/s1
InChI Key	CJAUDSQXFVZPTO-NSHDSACASA-N
MDL Number	MFCD08276411
Molecular Formula	C12H14O
Molecular Weight	174.2390
SMILES	O=C1C[C@@H](C2=CC=CC=C2)CCC1
Synonyms	(S)-3-Phenylcyclohexanone, 57344-86-2, Cyclohexanone, 3-phenyl-, (3S)-, SCHEMBL714527, CTK1G8802, DTXSID70455740, CJAUDSQXFVZPTO-NSHDSACASA-N, (S)-3-PHENYL-CYCLOHEXANONE, ZINC5029362, 8428AB, 8429AB, ANW-32684, MFCD08276411, AKOS015840423, FCH1122929, (3S)-3-PHENYLCYCLOHEXAN-1-ONE, AJ-52998, CJ-12406, AX8236689, TR-020018, FT-0774246, P1500, KS-00001412, -3-PHENYLCYCLOHEXANONE, C6H6F3N3, C12H14O, NSC119037, CID11116555, 4-methyl-6-(trifluoromethyl)pyrimidin-2-amine, 5734-63-4,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	174.104g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.243g/mol
Monoisotopic Mass	174.104g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited