CAS
97890-06-7 Purity
96%
97890-06-7 Purity
96%
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2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol
CAS
97890-10-3
Catalog Number
ACM97890103
Category
Other Products
Molecular Weight
236.392920 [g/mol]
Molecular Formula
C16H28O
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Specification
Synonyms
EINECS 308-189-4, CID113462, 2,4,4,6-Tetramethyltricyclo(6.4.0.02,7)dodecan-3-ol, 97890-10-3
IUPAC Name
2,2,4,8b-tetramethyl-1,3,4,4a,4b,5,6,7,8,8a-decahydrobiphenylen-1-ol
Canonical SMILES
CC1CC(C(C2(C1C3C2CCCC3)C)O)(C)C
InChI Key
MXCYLKRANYTTLV-UHFFFAOYSA-N
Boiling Point
311.3ºC at 760 mmHg
Flash Point
130.8ºC
Density
0.964g/cm³
EC Number
308-189-4
Exact Mass
236.21400
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol?
The molecular formula is C16H28O.
When was 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol created and modified in PubChem?
It was created on 2005-08-08 and modified on 2023-12-30.
What is the IUPAC name of 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol?
The IUPAC name is 2,2,4,8b-tetramethyl-1,3,4,4a,4b,5,6,7,8,8a-decahydrobiphenylen-1-ol.
What is the InChIKey of 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol?
The InChIKey is MXCYLKRANYTTLV-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol have?
It has 1 hydrogen bond donor count.
What is the exact mass of 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol?
The exact mass is 236.214015512 g/mol.
How many defined atom stereocenter counts does 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol have?
It has 0 defined atom stereocenter counts.
Is 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol a canonicalized compound in PubChem?
Yes, it is a canonicalized compound.
What is the XLogP3-AA value of 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol?
The XLogP3-AA value is 4.9.
How many heavy atoms does 2,4,4,6-Tetramethyltricyclo[6.4.0.02,7]dodecan-3-ol contain?
It contains 17 heavy atoms.
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