CAS
93919-51-8 Purity
96%
93919-51-8 Purity
96%
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3-[[2-[(2-Aminoethyl)amino]ethyl]amino]-2-hydroxypropyl neodecanoate
CAS
93919-60-9
Catalog Number
ACM93919609
Category
Other Products
Molecular Weight
331.493980 [g/mol]
Molecular Formula
C17H37N3O3
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Specification
Synonyms
EINECS 300-044-3, 3-((2-((2-Aminoethyl)amino)ethyl)amino)-2-hydroxypropyl neodecanoate, 93919-60-9
IUPAC Name
[3-[2-(2-aminoethylamino)ethylamino]-2-hydroxypropyl] 7,7-dimethyloctanoate
InChI Key
IVWNWZQVYIWMRA-UHFFFAOYSA-N
Exact Mass
331.28300
H-Bond Acceptor
6
H-Bond Donor
4
What is the molecular formula of the compound?
The molecular formula of the compound is C17H37N3O3.
When was the compound created and last modified?
The compound was created in 2009-08-20 and last modified on 2023-12-30.
What is the IUPAC name of the compound?
The IUPAC name of the compound is [3-[2-(2-aminoethylamino)ethylamino]-2-hydroxypropyl] 7,7-dimethyloctanoate.
What is the InChIKey of the compound?
The InChIKey of the compound is IVWNWZQVYIWMRA-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CC(C)(C)CCCCCC(=O)OCC(CNCCNCCN)O.
What is the CAS number of the compound?
The CAS number of the compound is 93919-60-9.
What is the molecular weight of the compound?
The molecular weight of the compound is 331.5 g/mol.
How many hydrogen bond donor counts are there in the compound?
There are 4 hydrogen bond donor counts in the compound.
How many hydrogen bond acceptor counts are there in the compound?
There are 6 hydrogen bond acceptor counts in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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