AG00FAPQ

6972-51-6 | 2,5-Dimethylphenethyl Alcohol

AG00FAPQ

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CAS Number	6972-51-6
Catalog Number	AG00FAPQ(AGN-PC-0JOJZ7)
Chemical Name	2,5-Dimethylphenethyl Alcohol
IUPAC Name	2-(2,5-dimethylphenyl)ethanol
InChI	InChI=1S/C10H14O/c1-8-3-4-9(2)10(7-8)5-6-11/h3-4,7,11H,5-6H2,1-2H3
InChI Key	JJJCAJWXGQKFCI-UHFFFAOYSA-N
MDL Number	MFCD00020610
Molecular Formula	C10H14O
Molecular Weight	150.2176
NSC Number	62109
SMILES	CC1=CC=C(C)C(CCO)=C1
Synonyms	2-(2,5-dimethylphenyl)ethanol, 6972-51-6, 2,5-DIMETHYLPHENETHYL ALCOHOL, 2-(2,5-dimethylphenyl)ethan-1-ol, Benzeneethanol,2,5-dimethyl-, NSC62109, AC1L6KCW, AC1Q7CKN, AC1Q2IL1, SCHEMBL698983, CTK5D1085, DTXSID00289590, OTAVA-BB 1779252, ZINC1691009, CK1129, MFCD00020610, NSC-62109, SBB005840, AKOS011828380, AS00587, MCULE-5019633603, AJ-30088, AS-45833, CJ-28152, AB0034243, CS-0061224, FT-0756282, ST50409269, X8364, 2,5-dimethylphenylmethyl carbinol, C10H14O, AR-1C6453, CID247479, 32917-52-5, 89639-76-9,

Complexity	111
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.104g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.221g/mol
Monoisotopic Mass	150.104g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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