CAS
94201-34-0 Purity
96%
94201-34-0 Purity
96%
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3,7-Dimethyl-2-methyleneoctan-1-ol
CAS
94201-37-3
Catalog Number
ACM94201373
Category
Other Products
Molecular Weight
170.291780 [g/mol]
Molecular Formula
C11H22O
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Specification
Synonyms
EINECS 303-622-3, 3,7-Dimethyl-2-methyleneoctan-1-ol, CID3023988, 94201-37-3
IUPAC Name
3,7-dimethyl-2-methylideneoctan-1-ol
Canonical SMILES
CC(C)CCCC(C)C(=C)CO
InChI Key
GQDKFEMTTWAVMQ-UHFFFAOYSA-N
Boiling Point
215.7ºC at 760mmHg
Flash Point
89ºC
Density
0.837g/cm³
EC Number
303-622-3
Exact Mass
170.16700
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The molecular formula is C11H22O.
When was 3,7-Dimethyl-2-methyleneoctan-1-ol created on PubChem?
It was created on 2005-08-08.
What is the IUPAC name of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The IUPAC name is 3,7-dimethyl-2-methylideneoctan-1-ol.
What is the molecular weight of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The molecular weight is 170.29 g/mol.
What is the Canonical SMILES of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The Canonical SMILES is CC(C)CCCC(C)C(=C)CO.
What is the XLogP3-AA value of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The XLogP3-AA value is 4.
How many hydrogen bond donor and acceptor counts are present in 3,7-Dimethyl-2-methyleneoctan-1-ol?
There is 1 hydrogen bond donor and 1 hydrogen bond acceptor count.
What is the topological polar surface area of 3,7-Dimethyl-2-methyleneoctan-1-ol?
The topological polar surface area is 20.2 Å2.
How many rotatable bond counts are there in 3,7-Dimethyl-2-methyleneoctan-1-ol?
There are 6 rotatable bond counts.
Is the compound a canonicalized form in PubChem?
Yes, the compound is canonicalized in PubChem.
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