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101347-44-8 | 1,4,7,10-Tetraoxa-13-azacyclopentadecane, 13-[bis(1-aziridinyl)phosphinyl]-
CAS No: 101347-44-8 Catalog No: AG0004A2 MDL No:
Product Description
Catalog Number:
AG0004A2
Chemical Name:
1,4,7,10-Tetraoxa-13-azacyclopentadecane, 13-[bis(1-aziridinyl)phosphinyl]-
CAS Number:
101347-44-8
Molecular Formula:
C14H28N3O5P
Molecular Weight:
349.3630
IUPAC Name:
13-[bis(aziridin-1-yl)phosphoryl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
InChI:
InChI=1S/C14H28N3O5P/c18-23(15-1-2-15,16-3-4-16)17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-17/h1-14H2
InChI Key:
HZJINMTVVVKUGS-UHFFFAOYSA-N
SMILES:
O=P(N1CC1)(N1CC1)N1CCOCCOCCOCCOCC1
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.177g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.368g/mol
Monoisotopic Mass:
349.177g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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