CAS
94277-81-3 Purity
96%
94277-81-3 Purity
96%
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1-(Butoxymethyl)-3-octadecylurea
CAS
94277-84-6
Catalog Number
ACM94277846
Category
Other Products
Molecular Weight
398.666000 [g/mol]
Molecular Formula
C24H50N2O2
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Specification
Synonyms
1-(Butoxymethyl)-3-octadecylurea, 94277-84-6, EINECS 304-668-7, AC1MIG1B, CTK5H6216, AG-H-89163
IUPAC Name
1-(butoxymethyl)-3-octadecylurea
SMILES
CCCCCCCCCCCCCCCCCCNC(=O)NCOCCCC
InChI Key
HWSGWVHMCJKESQ-UHFFFAOYSA-N
Boiling Point
524.3ºC at 760mmHg
Flash Point
270.9ºC
Density
0.894g/cm³
EC Number
304-668-7
Exact Mass
398.38700
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of the compound 1-(Butoxymethyl)-3-octadecylurea?
The molecular formula is C24H50N2O2.
When was the compound first created?
The compound was created on August 8, 2005.
What is the molecular weight of 1-(Butoxymethyl)-3-octadecylurea?
The molecular weight is 398.7 g/mol.
What is the synonym for 1-(Butoxymethyl)-3-octadecylurea?
One of the synonyms is 94277-84-6.
What is the InChIKey for the compound?
The InChIKey is HWSGWVHMCJKESQ-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in 1-(Butoxymethyl)-3-octadecylurea?
There are 2 hydrogen bond donor counts.
What is the XLogP3-AA value for the compound?
The XLogP3-AA value is 9.4.
How many rotatable bond counts are there in 1-(Butoxymethyl)-3-octadecylurea?
There are 22 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 50.4 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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