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L-Serine,N-(1-oxododecyl)-, monosodium salt (9CI) (70609-64-2)

Identification
Name:L-Serine,N-(1-oxododecyl)-, monosodium salt (9CI)
Synonyms:SodiumN-lauroylserine;Sodium N-dodecanoyl-L-serinate;Sodium N-(1-oxododecyl)-L-serinate;
CAS:70609-64-2
EINECS: 274-694-0
Molecular Formula: C15H28NNaO4
Molecular Weight: 309.38
InChI: InChI=1/C15H29NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-14(18)16-13(12-17)15(19)20;/h13,17H,2-12H2,1H3,(H,16,18)(H,19,20);/q;+1/p-1/t13-;/m0./s1
Molecular Structure: (C15H28NNaO4) SodiumN-lauroylserine;Sodium N-dodecanoyl-L-serinate;Sodium N-(1-oxododecyl)-L-serinate;
Properties
Specification:

The CAS register number of Sodium N-dodecanoyl-L-serinate is 70609-64-2. It also can be called as Sodium N-(1-oxododecyl)-L-serinate and the IUPAC name about this chemical is sodium (2S)-2-(dodecanoylamino)-3-hydroxypropanoate. The molecular formula about this chemical is C15H28NNaO4 and molecular weight is 309.38.

Physical properties about Sodium N-dodecanoyl-L-serinate are: (1)#H bond acceptors: 5 ; (2)#H bond donors: 3 ; (3)#Freely Rotating Bonds: 14 ; (4)Polar Surface Area: 89.46Å2; (5)H-Bond Donor: 2; (6)H-Bond Acceptor: 4; (7)Rotatable Bond Count: 13; (8)Tautomer Count: 2; (9)Exact Mass: 309.191603; (10)MonoIsotopic Mass: 309.191603; (11)Topological Polar Surface Area: 89.5; (12)Heavy Atom Count: 21; (13)Complexity: 274; (14)Defined Atom StereoCenter Count: 1; (15)Covalently-Bonded Unit Count: 2.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].O=C([O-])[C@@H](NC(=O)CCCCCCCCCCC)CO
(2)InChI: InChI=1/C15H29NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-14(18)16-13(12-17)15(19)20;/h13,17H,2-12H2,1H3,(H,16,18)(H,19,20);/q;+1/p-1/t13-;/m0./s1
(3)InChIKey: WSGBFSXSXAKJJC-QECFPYCSBI
(4)Std. InChI: InChI=1S/C15H29NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-14(18)16-13(12-17)15(19)20;/h13,17H,2-12H2,1H3,(H,16,18)(H,19,20);/q;+1/p-1/t13-;/m0./s1
(5)Std. InChIKey: WSGBFSXSXAKJJC-ZOWNYOTGSA-M

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