CAS
98690-31-4 Purity
96%
98690-31-4 Purity
96%
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Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate
CAS
98690-35-8
Catalog Number
ACM98690358
Category
Other Products
Molecular Weight
512.851420 [g/mol]
Molecular Formula
C30H54O3S.xH3N
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Specification
Synonyms
CTK5I0029, AG-I-00219, Ammonium (1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulphonate, 98690-35-8
IUPAC Name
azanium;4,6,8,10,12,14,16-heptamethylheptadecan-2-yl benzenesulfonate
InChI Key
JPCYALYUEBURKD-UHFFFAOYSA-O
Boiling Point
607ºC at 760 mmHg
Flash Point
320.9ºC
Exact Mass
511.40600
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The molecular formula is C30H57NO3S.
What is the molecular weight of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The molecular weight is 511.8 g/mol.
What are the synonyms for Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The synonyms include Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate.
What is the IUPAC name of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The IUPAC name is azanium; 2-(4,6,8,10,12,14,16-heptamethylheptadecan-2-yl)benzenesulfonate.
What is the InChI key of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The InChI key is KSMFOTKAFZGMFX-UHFFFAOYSA-N.
How many hydrogen bond donor count does Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate have?
It has 1 hydrogen bond donor count.
What is the exact mass of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The exact mass is 511.40591585 g/mol.
How many rotatable bond count does Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate have?
It has 15 rotatable bond count.
What is the topological polar surface area of Ammonium(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate?
The topological polar surface area is 66.6 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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