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261909-49-3 | L-Alanine, N-(chlorophenoxyphosphinyl)-, 1-Methylethyl ester
CAS No: 261909-49-3 Catalog No: AG002S4W MDL No:
Product Description
Catalog Number:
AG002S4W
Chemical Name:
L-Alanine, N-(chlorophenoxyphosphinyl)-, 1-Methylethyl ester
CAS Number:
261909-49-3
Molecular Formula:
C12H17ClNO4P
Molecular Weight:
305.6944
IUPAC Name:
propan-2-yl (2S)-2-[[chloro(phenoxy)phosphoryl]amino]propanoate
InChI:
InChI=1S/C12H17ClNO4P/c1-9(2)17-12(15)10(3)14-19(13,16)18-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,14,16)/t10-,19?/m0/s1
InChI Key:
SKAAFTUHFLUIKV-IHBJSSOOSA-N
SMILES:
C[C@@H](C(=O)OC(C)C)NP(=O)(Oc1ccccc1)Cl
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
305.058g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.695g/mol
Monoisotopic Mass:
305.058g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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