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123704-87-0 | 1,3,2-Diazaphosphorine, 2-chlorohexahydro-1,3-bis(1-methylethyl)-
CAS No: 123704-87-0 Catalog No: AG000KYR MDL No:
Product Description
Catalog Number:
AG000KYR
Chemical Name:
1,3,2-Diazaphosphorine, 2-chlorohexahydro-1,3-bis(1-methylethyl)-
CAS Number:
123704-87-0
Molecular Formula:
C9H20ClN2P
Molecular Weight:
222.6953
IUPAC Name:
2-chloro-1,3-di(propan-2-yl)-1,3,2-diazaphosphinane
InChI:
InChI=1S/C9H20ClN2P/c1-8(2)11-6-5-7-12(9(3)4)13(11)10/h8-9H,5-7H2,1-4H3
InChI Key:
HZXVCEJYFXEUOG-UHFFFAOYSA-N
SMILES:
CC(N1CCCN(P1Cl)C(C)C)C
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.697g/mol
Monoisotopic Mass:
222.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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