CAS
94201-79-3 Purity
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94201-79-3 Purity
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Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate
CAS
94201-82-8
Catalog Number
ACM94201828
Category
Other Products
Molecular Weight
453.589870 [g/mol]
Molecular Formula
C26H41NO4Na
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Specification
Synonyms
EINECS 303-672-6, CID3024006, Sodium 4-(((1-oxooctadecyl)amino)carbonyl)benzoate, 94201-82-8
IUPAC Name
sodium 4-(octadecanoylcarbamoyl)benzoate
SMILES
CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=CC=C(C=C1)C(=O)[O-].[Na+]
InChI Key
PCYDUGMBAYGAAR-UHFFFAOYSA-M
Boiling Point
593.5ºC at 760mmHg
Flash Point
312.8ºC
EC Number
303-672-6
Exact Mass
453.28600
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
The molecular formula of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is C26H40NNaO4.
What is the molecular weight of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
The molecular weight of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is 453.6 g/mol.
What are some synonyms for Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
Some synonyms for Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate are 94201-82-8, EINECS 303-672-6, and SODIUM 4-[[(1-OXOOCTADECYL)AMINO]CARBONYL]BENZOATE.
When was Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate created in PubChem?
Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate was created in PubChem on 2008-02-05.
What is the InChIKey for Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
The InChIKey for Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is PCYDUGMBAYGAAR-UHFFFAOYSA-M.
How many hydrogen bond donor counts are there in Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
There is 1 hydrogen bond donor count in Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate.
What is the exact mass of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
The exact mass of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is 453.28550304 g/mol.
How many rotatable bond counts are there in Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
There are 18 rotatable bond counts in Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate.
What is the topological polar surface area of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate?
The topological polar surface area of Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is 86.3 Ų.
Is Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate considered canonicalized?
Yes, Sodium 4-[[(1-oxooctadecyl)amino]carbonyl]benzoate is considered canonicalized in PubChem.
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