CAS
90-99-3 Purity
MP 15-17deg
90-99-3 Purity
MP 15-17deg
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Dimethylbenzylcarbinol
CAS
100-86-7
Catalog Number
ACM100867
Category
Aryl
Molecular Weight
150.221g/mol
Molecular Formula
C10H14O;
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Specification
Synonyms
AKOS009156717; Dimethylbenzylcarbinol; NSC27228; FEMA No. 2393; MFCD00004465; alpha,alpha-dimethylphenylethyl alcohol; DTXSID1047601; 2-Methyl-1-phenylpropan-2-ol; Phenethyl alcohol, .alpha.,.alpha.-dimethyl-; WLN: QX1 & 1 & 1R;
IUPAC Name
2-methyl-1-phenylpropan-2-ol;
Canonical SMILES
CC(C)(CC1=CC=CC=C1)O;
InChI
InChI=1S/C10H14O/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3;
InChI Key
RIWRBSMFKVOJMN-UHFFFAOYSA-N;
Melting Point
24.0°C;24°C;
Storage
Store below +30°C.
Complexity
112
Covalently-Bonded Unit Count
1
EC Number
202-896-0
Exact Mass
150.104g/mol
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
11
Monoisotopic Mass
150.104g/mol
NSC Number
46103
Physical Description
Liquid;Solid;
Rotatable Bond Count
2
Topological Polar Surface Area
20.2A^2
UNII
N95NCI59MI
What is the molecular formula of Dimethylbenzylcarbinol?
The molecular formula of Dimethylbenzylcarbinol is C10H14O.
What is the molecular weight of Dimethylbenzylcarbinol?
The molecular weight of Dimethylbenzylcarbinol is 150.22 g/mol.
What is the IUPAC name of Dimethylbenzylcarbinol?
The IUPAC name of Dimethylbenzylcarbinol is 2-methyl-1-phenylpropan-2-ol.
What is the InChI of Dimethylbenzylcarbinol?
The InChI of Dimethylbenzylcarbinol is InChI=1S/C10H14O/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3.
What is the InChIKey of Dimethylbenzylcarbinol?
The InChIKey of Dimethylbenzylcarbinol is RIWRBSMFKVOJMN-UHFFFAOYSA-N.
What is the canonical SMILES of Dimethylbenzylcarbinol?
The canonical SMILES of Dimethylbenzylcarbinol is CC(C)(CC1=CC=CC=C1)O.
What is the CAS number of Dimethylbenzylcarbinol?
The CAS number of Dimethylbenzylcarbinol is 100-86-7.
What is the EC Number of Dimethylbenzylcarbinol?
The EC Number of Dimethylbenzylcarbinol is 202-896-0.
What is the FEMA Number of Dimethylbenzylcarbinol?
The FEMA Number of Dimethylbenzylcarbinol is 2393.
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