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18228-80-3 | Phosphorodiamidic acid, N,N-bis(2-chloroethyl)-, phenylmethyl ester
CAS No: 18228-80-3 Catalog No: AG0023K3 MDL No:
Product Description
Catalog Number:
AG0023K3
Chemical Name:
Phosphorodiamidic acid, N,N-bis(2-chloroethyl)-, phenylmethyl ester
CAS Number:
18228-80-3
Molecular Formula:
C11H17Cl2N2O2P
Molecular Weight:
311.1446
IUPAC Name:
N-[amino(phenylmethoxy)phosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine
InChI:
InChI=1S/C11H17Cl2N2O2P/c12-6-8-15(9-7-13)18(14,16)17-10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,14,16)
InChI Key:
JSZWFLWJWIMZLD-UHFFFAOYSA-N
SMILES:
ClCCN(P(=O)(OCc1ccccc1)N)CCCl
NSC Number:
69942
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.04g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.143g/mol
Monoisotopic Mass:
310.04g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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