AG003ELP

4471-05-0 | 1-Phenylhexan-1-ol

AG003ELP

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CAS Number	4471-05-0
Catalog Number	AG003ELP(AGN-PC-0RT6QP)
Chemical Name	1-Phenylhexan-1-ol
IUPAC Name	1-phenylhexan-1-ol
InChI	InChI=1S/C12H18O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9,12-13H,2-3,5,10H2,1H3
InChI Key	SVCRDVHXRDRHCP-UHFFFAOYSA-N
MDL Number	MFCD02258728
Molecular Formula	C12H18O
Molecular Weight	178.2707
NSC Number	5687
SMILES	CCCCCC(C1=CC=CC=C1)O
Synonyms	1-Phenyl-1-hexanol, 1-phenylhexan-1-ol, 4471-05-0, SVCRDVHXRDRHCP-UHFFFAOYSA-N, phenyl hexanol, NSC5687, ACMC-209jzo, 1-Phenyl-1-hexanol #, AC1Q2VOS, alpha-Pentylbenzyl Alcohol, Benzenemethanol, a-pentyl-, AC1L5A1W, SCHEMBL317208, AC1Q771U, CTK4I8416, Benzenemethanol, .alpha.-pentyl-, DTXSID50278010, KS-000012JU, NSC-5687, ANW-30178, MFCD02258728, AKOS008139490, MCULE-4426936102, NE24408, TC-118923, P1683, EN300-60982, I14-100428, AR-1C5184, CID221292, 5431-41-4,

Complexity	116
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	5
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number