AG00C6XQ

42822-86-6 | p-Menthane-3,8-diol

AG00C6XQ

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CAS Number	42822-86-6
Catalog Number	AG00C6XQ(AGN-PC-0WAEUF)
Chemical Name	p-Menthane-3,8-diol
FEMA Number	4053
IUPAC Name	2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol
InChI	InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3
InChI Key	LMXFTMYMHGYJEI-UHFFFAOYSA-N
MDL Number	MFCD12756283
Molecular Formula	C10H20O2
Molecular Weight	172.2646
SMILES	OC1C(C(C)(O)C)CCC(C)C1
UNII	6T6Z1Z1NC4
Synonyms	2-(2'-hydroxypropan-2'-yl)-5-methylcyclohexanol, 2-hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol, geranodyle, p-menthane-1,8-diol, p-menthane-3,8-diol, para-menthane-3,8-diol, terpin, terpin hydrate, terpin, monohydrate(cis)-isomer, terpin, titanium (+4) salt, p-Menthane-3,8-diol, 42822-86-6, para-menthane-3,8-diol, 3,8-p-menthanediol, 2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol, UNII-6T6Z1Z1NC4, 2-Hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol, 6T6Z1Z1NC4, 2-(2-Hydroxypropan-2-yl)-5-methylcyclohexanol, LMXFTMYMHGYJEI-UHFFFAOYSA-N, Cyclohexanemethanol,2-hydroxy-a,a,4-trimethyl-, 2-Hydroxy-|A,|A,4-trimethylcyclohexanemethanol, trans-p-Menthane-3,8-diol, 2-(1-Hydroxy-1-methylethyl)-5-methylcyclohexanol, W-106259, 8-hydroxymenthol, Isopulegol hydrate, Citriodiol, Geranodyle, Geranium cyclohexane, 3564-98-5, trans-2-(2-Hydroxypropan-2-yl)-5-methylcyclohexanol, Cubebaol, EINECS 255-953-7, AC1LBFDW, SCHEMBL80731, DTXSID0035744, CHEBI:48250, CTK4I6636, p-Menthane-3,8-diol (Natural), AN-185, AKOS015902316, FCH1115966, MCULE-7074521102, TRA0066073, cis-1,3,trans-1,4-p-Menthane-3,8-diol, (1Alpha,3beta,4beta)-p-menthane-3,8-diol, FT-0770276, 2-(2-hydroxy-2-propyl)-5-methyl-cyclohexanol, 2-Hydroxy-a,a,4-trimethylcyclohexanemethanol, 9CI, 822M866, 2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohexanol, 2-Hydroxy-alpha,alpha,4-trimethyl-Cyclohexanemethanol, I14-13730, Cyclohexanemethanol, 2-hydroxy-alpha,alpha,4-trimethyl-, Menthoglycol, C10H20O2, CID556998, C10-H20-O2, Ciclohexanometanol, 2-hidroxi-?,?,4-trimetil-, Cyclohexanemethanol, 2-hydroxy-.alpha.,.alpha.,4-trimethyl-, 1-hydroxy-2-(1-methyl-1-hydroxyethyl)-5-methylcyclohexane,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.146g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	172.268g/mol
Monoisotopic Mass	172.146g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	3
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number