CAS
93840-04-1 Purity
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93840-04-1 Purity
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Methyl octahydro-8,8-dimethyl-2-naphthoate
CAS
93840-14-3
Catalog Number
ACM93840143
Category
Other Products
Molecular Weight
224.339160 [g/mol]
Molecular Formula
C14H22O2
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Specification
Synonyms
EINECS 298-886-9, Methyl octahydro-8,8-dimethyl-2-naphthoate, 93840-14-3
IUPAC Name
methyl 8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalene-2-carboxylate
Canonical SMILES
CC1(CCCC2C1CC(CC2)C(=O)OC)C
InChI Key
RMMKMJKKPAEWNV-UHFFFAOYSA-N
EC Number
298-886-9
Exact Mass
224.17800
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The molecular formula is C14H24O2.
What are some synonyms for Methyl octahydro-8,8-dimethyl-2-naphthoate?
Some synonyms include Methyl 8,8-dimethyldecahydronaphthalene-2-carboxylate and EINECS 298-886-9.
What is the molecular weight of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The molecular weight is 224.34 g/mol.
What is the IUPAC Name of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The IUPAC Name is methyl 8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalene-2-carboxylate.
What is the InChIKey of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The InChIKey is RMMKMJKKPAEWNV-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are there in Methyl octahydro-8,8-dimethyl-2-naphthoate?
There are 2 hydrogen bond acceptor counts.
What is the XLogP3-AA value of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The XLogP3-AA value is 4.2.
How many rotatable bond counts are there in Methyl octahydro-8,8-dimethyl-2-naphthoate?
There are 2 rotatable bond counts.
What is the topological polar surface area of Methyl octahydro-8,8-dimethyl-2-naphthoate?
The topological polar surface area is 26.3 Ų.
Is Methyl octahydro-8,8-dimethyl-2-naphthoate a canonicalized compound?
Yes, it is a canonicalized compound.
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