AG003LBZ

768-59-2 | 4-Ethylbenzyl alcohol

AG003LBZ

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CAS Number	768-59-2
Catalog Number	AG003LBZ(AGN-PC-0JKAXW)
Chemical Name	4-Ethylbenzyl alcohol
EC Number	212-198-8
IUPAC Name	(4-ethylphenyl)methanol
InChI	InChI=1S/C9H12O/c1-2-8-3-5-9(7-10)6-4-8/h3-6,10H,2,7H2,1H3
InChI Key	YSLBFFIVJGJBSA-UHFFFAOYSA-N
MDL Number	MFCD00004666
Molecular Formula	C9H12O
Molecular Weight	136.1910
SMILES	CCC1=CC=C(CO)C=C1
Synonyms	(4-Ethylphenyl)methanol, 768-59-2, 4-ETHYLBENZYL ALCOHOL, 4-Ethylbenzylalcohol, Benzenemethanol, 4-ethyl-, Benzyl alcohol, p-ethyl-, p-Ethylbenzyl alcohol, YSLBFFIVJGJBSA-UHFFFAOYSA-N, MFCD00004666, EINECS 212-198-8, 4-EthYl-Benzyl Alcohol, AI3-21535, Benzenemethanol,4-ethyl-, ACMC-209p6g, (4-Ethylphenyl)methanol #, AC1Q2TJ7, AC1Q2TJ8, (4-ethylphenyl)methan-1-ol, SCHEMBL92935, 4-Ethylbenzyl alcohol, 99%, AC1L20W5, CTK3J2791, DTXSID00227614, KS-000016PG, ZINC2031133, 1984AC, ANW-36902, CE-676, AKOS000249533, MCULE-1638411510, NE59631, RTC-070173, AJ-32912, CJ-31733, SC-50580, TC-070173, E0704, FT-0690437, ST24034681, ST51028315, I14-45610, InChI=1/C9H12O/c1-2-8-3-5-9(7-10)6-4-8/h3-6,10H,2,7H2,1H, 4-ethyl-benzenemethanol, C9H12O, C9-H12-O, CID13034, 4-Ethylbenzyl alcohol, 97% - 25G 25g,

Complexity	82.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.089g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	136.194g/mol
Monoisotopic Mass	136.089g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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