AG0085G9

103694-68-4 | 2,2-Dimethyl-3-(m-tolyl)propan-1-ol

AG0085G9

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CAS Number	103694-68-4
Catalog Number	AG0085G9(AGN-PC-0JNDS2)
Chemical Name	2,2-Dimethyl-3-(m-tolyl)propan-1-ol
EC Number	403-140-4
IUPAC Name	2,2-dimethyl-3-(3-methylphenyl)propan-1-ol
InChI	InChI=1S/C12H18O/c1-10-5-4-6-11(7-10)8-12(2,3)9-13/h4-7,13H,8-9H2,1-3H3
InChI Key	FYMOBFDUZIDKMI-UHFFFAOYSA-N
MDL Number	MFCD03701092
Molecular Formula	C12H18O
Molecular Weight	178.2707
SMILES	OCC(C)(C)CC1=CC=CC(C)=C1
UNII	7S411YY2VY
Synonyms	majantol, 103694-68-4, 2,2-Dimethyl-3-(m-tolyl)propan-1-ol, Majantol, 2,2-Dimethyl-3-(3-methylphenyl)propanol, 3-(2,2-dimethyl-3-hydroxypropyl)toluene, UNII-7S411YY2VY, 2,2-dimethyl-3-(3-methylphenyl)propan-1-ol, Benzenepropanol, beta,beta,3-trimethyl-, 7S411YY2VY, 2,2-dimethyl-3-(3-methylphenyl)-propanol, 2,2-dimethyl-3-(3-methylphenyl)-propan-1-ol, 2,2-DIMETHYL-3-(3-METHYLPHENYL) PROPANOL, Benzenepropanol, .beta.,.beta.,3-trimethyl-, ACMC-20m6j5, EC 403-140-4, AC1L41TW, SCHEMBL113407, DTXSID0051520, CTK4A2324, FYMOBFDUZIDKMI-UHFFFAOYSA-N, KS-00000MJ4, ZINC2509717, 2,2-dimethyl-3-m-tolylpropan-1-ol, Benzenepropanol, ss,ss,3-trimethyl-, MFCD03701092, AKOS006280053, Benzenepropanol, |A,|A,3-trimethyl-, DS-8015, 2,2-Dimethyl-3-(3-tolyl)propan-1-ol, AK163139, AN-34140, SC-24443, FT-0628105, ST24038430, I01-9172, beta,beta,3-Trimethylbenzenepropanol, analytical standard, beta,beta,3-Trimethylbenzenepropanol, reference material, F2147-6231, 2,4-Dimethyl-4,4a,5,9b-tetrahydroindenoa[1,2:d]-m-dioxin, Trimethylbenzenepropanol, ?,?,3-Trimethylbenzenepropanol, |A,|A,3-Trimethylbenzenepropanol, Bencenpropanol, ?,?,3-trimetil-, C12-H18-O, CID175948, .beta.,.beta.,3-Trimethyl benzenepropanol, 27606-09-3,

Complexity	151
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	3
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H412
Packing Group
Precautionary statements	P273
UN Code

Certificate of Analysis

Lot Number