AG003EM7

10415-87-9 | 3-Methyl-1-phenylpentan-3-ol

AG003EM7

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CAS Number	10415-87-9
Catalog Number	AG003EM7(AGN-PC-0OSYKM)
Chemical Name	3-Methyl-1-phenylpentan-3-ol
EC Number	233-889-0
FEMA Number	2883
IUPAC Name	3-methyl-1-phenylpentan-3-ol
InChI	InChI=1S/C12H18O/c1-3-12(2,13)10-9-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3
InChI Key	AEJRTNBCFUOSEM-UHFFFAOYSA-N
MDL Number	MFCD00021825
Molecular Formula	C12H18O
Molecular Weight	178.2707
NSC Number	60568
SMILES	CCC(O)(C)CCC1=CC=CC=C1
Synonyms	1-phenyl-3-methyl-3-pentanol, 3-Methyl-1-phenyl-3-pentanol, 3-Methyl-1-phenylpentan-3-ol, 10415-87-9, 1-Phenyl-3-methyl-3-pentanol, Pemec, Phenethylmethylethylcarbinol, Phenylethyl methyl ethyl carbinol, 3-Pentanol, 3-methyl-1-phenyl-, Benzenepropanol, .alpha.-ethyl-.alpha.-methyl-, FEMA No. 2883, Benzenepropanol, alpha-ethyl-alpha-methyl-, EINECS 233-889-0, NSC 60568, alpha-Ethyl-alpha-methylbenzenepropanol, BRN 2354074, AI3-24336, 3-methyl-1-phenyl-pentan-3-ol, AEJRTNBCFUOSEM-UHFFFAOYSA-N, .beta.-Phenylethylmethylethylcarbinol, lilac pentanol, 2-Phenethyl-2-butanol, AC1L1VEB, AC1Q2RZI, Ethylmethylphenethylcarbinol, Phenylethylmethylethylcarbinol, phenylethylmethylethyl carbinol, SCHEMBL114480, a-Ethyl-a-methylbenzenepropanol, ACMC-2098b4, FEMA 2883, 3-Methyl-1-phenyl-3-pentanol #, NSC60568, ANW-15038, MFCD00021825, NSC-60568, AKOS009158614, 3-Methyl-1-phenyl-3-pentanol, 98%, LS-3042, MCULE-5168620248, KS-000013Z7, 1-Phenyl-3-methyl-3-pentanol, >=98%, AN-20415, TC-103783, FT-0692217, M2011, A800908, J-001119, I14-52018, UNII-53PK0CX9TS, 53PK0CX9TS, C12H18O, Benzenepropanol, ?-ethyl-?-methyl-, Bencenpropanol, ?-etil-?-metil-, CID61516, C12-H18-O, R411, 3 - methyl - 1 - phenylpentan - 3 - ol, 4-06-00-03420 (Beilstein Handbook Reference),

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.136g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.275g/mol
Monoisotopic Mass	178.136g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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