AG003KLO

18594-05-3 | 1-(4-cyclohexylphenyl)ethan-1-one

AG003KLO

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CAS Number	18594-05-3
Catalog Number	AG003KLO(AGN-PC-0JLWZ6)
Chemical Name	1-(4-cyclohexylphenyl)ethan-1-one
EC Number	242-432-4
IUPAC Name	1-(4-cyclohexylphenyl)ethanone
InChI	InChI=1S/C14H18O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3
InChI Key	MSDQNIRGPBARGC-UHFFFAOYSA-N
MDL Number	MFCD00001453
Molecular Formula	C14H18O
Molecular Weight	202.2921
SMILES	CC(C1=CC=C(C2CCCCC2)C=C1)=O
Synonyms	4'-Cyclohexylacetophenone, 18594-05-3, 1-(4-Cyclohexylphenyl)ethanone, 1-(4-Cyclohexylphenyl)ethan-1-one, 4-Cyclohexylacetophenone, Ethanone, 1-(4-cyclohexylphenyl)-, MSDQNIRGPBARGC-UHFFFAOYSA-N, MFCD00001453, 1-acetyl-4-cyclohexylbenzene, EINECS 242-432-4, p-cyclohexylacetophenone, ACMC-209ena, 4-cyclohexylace-tophenone, AC1Q1JOC, AC1Q1JOD, AC1Q1JOE, 4'-cyclohexyl actephenone, 4'-cyclohexyl acetophenone, 4'-cyclohexyl-acetophenone, para-cyclohexyl-acetophenone, AC1L3E8U, AC1Q5DX4, SCHEMBL967133, p-cyclohexylphenyl methyl ketone, 1-(4-cyclohexylphenyl)-ethanone, 4'-Cyclohexylacetophenone, 99%, MSDQNIRGPBARGC-UHFFFAOYSA-, DTXSID70171817, 1-(4-cyclohexyl-phenyl)-ethanone, 1-(4-Cyclohexylphenyl)ethanone #, ALBB-020867, KS-00000WF8, STR04122, ZINC1081064, 6236AD, ANW-23252, BBL004911, SBB056546, STL138370, AKOS000119331, MCULE-9588329362, VZ27353, UPCMLD0ENAT5883753:001, SC-94800, ZB015849, AB1002769, DB-028850, TC-111997, BB 0221152, FT-0618317, H2511, ST50307656, EN300-20139, J-011925, I14-50354, F0001-0670, InChI=1/C14H18O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3, null, 4-ACETYLBIPHENYL, C14H18O, CID87715, AR-1G2039, c1217, C14-H18-O, 92-91-1, 190-22-7,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.136g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	202.297g/mol
Monoisotopic Mass	202.136g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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