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830320-80-4 | L-Alanine, N-[bis(tetradecyloxy)phosphinyl]-
CAS No: 830320-80-4 Catalog No: AG0053HN MDL No:
Product Description
Catalog Number:
AG0053HN
Chemical Name:
L-Alanine, N-[bis(tetradecyloxy)phosphinyl]-
CAS Number:
830320-80-4
Molecular Formula:
C31H64NO5P
Molecular Weight:
561.8173
IUPAC Name:
(2S)-2-[di(tetradecoxy)phosphorylamino]propanoic acid
InChI:
InChI=1S/C31H64NO5P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-36-38(35,32-30(3)31(33)34)37-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h30H,4-29H2,1-3H3,(H,32,35)(H,33,34)/t30-/m0/s1
InChI Key:
NLNPBEVHMJCDNC-PMERELPUSA-N
SMILES:
CCCCCCCCCCCCCCOP(=O)(N[C@H](C(=O)O)C)OCCCCCCCCCCCCCC
Properties
Complexity:
526
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
561.452g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
561.829g/mol
Monoisotopic Mass:
561.452g/mol
Rotatable Bond Count:
31
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.6
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