CAS
96097-14-2 Purity
96%
96097-14-2 Purity
96%
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7-Methyl-1-octyl formate
CAS
96097-17-5
Catalog Number
ACM96097175
Category
Other Products
Molecular Weight
172.264600 [g/mol]
Molecular Formula
C10H20O2
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Specification
Synonyms
Isononyl formate, 7-Methyl-1-octyl formate, EINECS 265-574-9, EINECS 306-096-3, CID3024517, 65155-46-6, 96097-17-5
IUPAC Name
7-methyloctyl formate
Canonical SMILES
CC(C)CCCCCCOC=O
InChI Key
YHHQTENWSYRAKA-UHFFFAOYSA-N
EC Number
265-574-9
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 7-Methyl-1-octyl formate?
The molecular formula of 7-Methyl-1-octyl formate is C10H20O2.
What is the molecular weight of 7-Methyl-1-octyl formate?
The molecular weight of 7-Methyl-1-octyl formate is 172.26 g/mol.
When was 7-Methyl-1-octyl formate created in PubChem?
7-Methyl-1-octyl formate was created in PubChem on August 8, 2005.
What is the IUPAC name of 7-Methyl-1-octyl formate?
The IUPAC name of 7-Methyl-1-octyl formate is 7-methyloctyl formate.
What is the InChIKey of 7-Methyl-1-octyl formate?
The InChIKey of 7-Methyl-1-octyl formate is YHHQTENWSYRAKA-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are there in 7-Methyl-1-octyl formate?
There are 2 hydrogen bond acceptor counts in 7-Methyl-1-octyl formate.
What is the XLogP3-AA value of 7-Methyl-1-octyl formate?
The XLogP3-AA value of 7-Methyl-1-octyl formate is 3.8.
What is the topological polar surface area of 7-Methyl-1-octyl formate?
The topological polar surface area of 7-Methyl-1-octyl formate is 26.3 Å2.
How many rotatable bond counts are present in 7-Methyl-1-octyl formate?
There are 8 rotatable bond counts in 7-Methyl-1-octyl formate.
Is 7-Methyl-1-octyl formate a canonicalized compound?
Yes, 7-Methyl-1-octyl formate is a canonicalized compound in PubChem.
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