AG001LMV

14938-35-3 | Phenol, 4-pentyl-

AG001LMV

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CAS Number	14938-35-3
Catalog Number	AG001LMV(AGN-PC-0BIRY9)
Chemical Name	Phenol, 4-pentyl-
EC Number	239-015-4
IUPAC Name	4-pentylphenol
InChI	InChI=1S/C11H16O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h6-9,12H,2-5H2,1H3
InChI Key	ZNPSUQQXTRRSBM-UHFFFAOYSA-N
MDL Number	MFCD00020211
Molecular Formula	C11H16O
Molecular Weight	164.2441
SMILES	OC1=CC=C(CCCCC)C=C1
UNII	40069Q368Q
Synonyms	4-pentylphenol, 4-PENTYLPHENOL, 4-n-Pentylphenol, 14938-35-3, Phenol, 4-pentyl-, 4-Amylphenol, 4-n-Amylphenol, p-Pentylphenol, p-Amylphenol, Phenol, p-pentyl-, 4-Pentyl-phenol, Amyl p-hydroxybenzene, UNII-40069Q368Q, EINECS 239-015-4, BRN 1364424, CHEBI:34441, ZNPSUQQXTRRSBM-UHFFFAOYSA-N, MFCD00020211, AK208719, 40069Q368Q, W-108086, p-n-Amylphenol, p-n-pentylphenol, AC1Q2VRD, p-Hydroxy-n-pentylbenzene, C14466, AC1L1C9N, ACMC-1C68L, DSSTox_CID_24164, DSSTox_GSID_44164, SCHEMBL30970, 4-06-00-03370 (Beilstein Handbook Reference), KSC174Q2F, BIDD:ER0050, CHEMBL153388, SGCUT00115, Jsp002832, DTXSID9044164, CTK0H4822, KS-000009BF, to_000011, ZINC2018962, Tox21_303837, ANW-21208, SBB059154, 4-Pentylphenol, >=98.0% (GC), AKOS000121477, MCULE-8456321538, RTR-006046, TRA0009131, ACM14938353, NCGC00356967-01, 1438-35-3, AS-15901, BBV-75779629, CC-20203, CJ-07411, CJ-31423, SC-54569, AX8000647, BB0296014, CAS-14938-35-3, DB-028993, LS-105039, TL8001075, TR-006046, FT-0617618, FT-0619318, P0843, ST50405718, C-04527, I01-3201, 4-n-Pentylphenol, 98% 5g, C11H16O, CID26975, C11-H16-O, 4-Pentylphenol, 98% - 100G 100g, R295, A3279, C000614719, 65916-15-6,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.12g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.248g/mol
Monoisotopic Mass	164.12g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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