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Structure

3-Cyclohexene-1-methanol,a,a-dimethyl-

CAS
90645-55-9
Catalog Number
ACM90645559
Category
Other Products
Molecular Weight
140.22274
Molecular Formula
C9H16 O

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Specification

Synonyms
alpha,alpha-Dimethylcyclohex-3-ene-1-methanol, 90645-55-9, AGN-PC-00LVI5, SureCN3316886, CTK5G8262, 2-cyclohex-3-en-1-ylpropan-2-ol, EINECS 292-638-3, AG-H-72030
IUPAC Name
2-cyclohex-3-en-1-ylpropan-2-ol
Canonical SMILES
CC(C)(C1CCC=CC1)O
InChI Key
FGCVUJGUQUFWLT-UHFFFAOYSA-N
Boiling Point
193.3ºC at 760 mmHg
Flash Point
73.9ºC
Density
0.953g/cm³
EC Number
292-638-3
Exact Mass
140.12000
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 3-Cyclohexene-1-methanol, a,a-dimethyl according to the reference?

The molecular formula of 3-Cyclohexene-1-methanol, a,a-dimethyl is C9H16O.

When was 3-Cyclohexene-1-methanol, a,a-dimethyl created and modified according to the reference?

It was created on 2007-02-08 and modified on 2023-12-30.

What is the IUPAC name of 3-Cyclohexene-1-methanol, a,a-dimethyl?

The IUPAC name is 2-cyclohex-3-en-1-ylpropan-2-ol.

What is the InChIKey of 3-Cyclohexene-1-methanol, a,a-dimethyl?

The InChIKey is FGCVUJGUQUFWLT-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does 3-Cyclohexene-1-methanol, a,a-dimethyl have?

It has 1 hydrogen bond acceptor count.

What is the topological polar surface area of 3-Cyclohexene-1-methanol, a,a-dimethyl?

The topological polar surface area is 20.2 Å2.

Is 3-Cyclohexene-1-methanol, a,a-dimethyl a canonicalized compound?

Yes, it is a canonicalized compound.

What is the complexity value of 3-Cyclohexene-1-methanol, a,a-dimethyl?

The complexity value is 136.

How many defined atom stereocenter counts does 3-Cyclohexene-1-methanol, a,a-dimethyl have?

It has 0 defined atom stereocenter counts.

How many rotatable bond counts does 3-Cyclohexene-1-methanol, a,a-dimethyl have?

It has 1 rotatable bond count.

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