AG00ILCJ

5515-76-4 | 2-Cyclohexen-1-one, 4-methyl-

AG00ILCJ

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CAS Number	5515-76-4
Catalog Number	AG00ILCJ(AGN-PC-0N4IGG)
Chemical Name	2-Cyclohexen-1-one, 4-methyl-
IUPAC Name	4-methylcyclohex-2-en-1-one
InChI	InChI=1S/C7H10O/c1-6-2-4-7(8)5-3-6/h2,4,6H,3,5H2,1H3
InChI Key	RKSNPTXBQXBXDJ-UHFFFAOYSA-N
MDL Number	MFCD00869736
Molecular Formula	C7H10O
Molecular Weight	110.1537
SMILES	CC1CCC(=O)C=C1
Synonyms	4-methyl-2-cyclohexenone, 4-methylcyclohex-2-en-1-one, 5515-76-4, 2-Cyclohexen-1-one, 4-methyl-, 4-Methylcyclohex-2-enone, 4-methyl-2-cyclohexen-1-one, 2-Cyclohexen-1-one, 4-methyl-, (S)-, ACMC-20m4rt, 4-methyl-2-cyclohexenone, SCHEMBL767441, 4-methyl-2-cyclohexene-1-one, 4-methyl-cyclohex-2-en-1-one, CTK1F7387, RKSNPTXBQXBXDJ-UHFFFAOYSA-N, 101758-35-4, MFCD00869736, KS-0000085P, AS-53939, CS-0051212, CID10920469,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	110.073g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	110.156g/mol
Monoisotopic Mass	110.073g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number