CAS
93804-58-1 Purity
96%
93804-58-1 Purity
96%
Inquiry Basket
1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol
CAS
93804-62-7
Catalog Number
ACM93804627
Category
Other Products
Molecular Weight
194.313180 [g/mol]
Molecular Formula
C13H22O
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Specification
Synonyms
1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol, 93804-62-7, AC1MID7J, CTK5H3233, EINECS 298-439-8, AG-H-83640, (8,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)methanol
IUPAC Name
(8,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)methanol
Canonical SMILES
CC1(CCCC2=C1CC(CC2)CO)C
InChI Key
TXYYNNGNKSJORA-UHFFFAOYSA-N
Boiling Point
283.9ºC at 760 mmHg
Flash Point
110.1ºC
Density
0.98g/cm³
EC Number
298-439-8
Exact Mass
194.16700
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The molecular formula is C13H22O.
What is the molecular weight of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The molecular weight is 194.31 g/mol.
When was 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol created and modified in PubChem?
It was created on 2005-08-08 and modified on 2023-12-30.
What is the IUPAC name of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The IUPAC name is (8,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)methanol.
What is the InChI of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The InChI is InChI=1S/C13H22O/c1-13(2)7-3-4-11-6-5-10(9-14)8-12(11)13/h10,14H,3-9H2,1-2H3.
What is the InChIKey of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The InChIKey is TXYYNNGNKSJORA-UHFFFAOYSA-N.
What is the Canonical SMILES of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The Canonical SMILES is CC1(CCCC2=C1CC(CC2)CO).
What is the XLogP3-AA of 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol?
The XLogP3-AA is 2.7.
How many hydrogen bond donor counts does 1,2,3,4,5,6,7,8-Octahydro-8,8-dimethylnaphthalene-2-methanol have?
It has 1 hydrogen bond donor count.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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