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21135-08-0 | 1,3,2-Dioxaphosphorinane, 2-chloro-5-(1,1-dimethylethyl)-
CAS No: 21135-08-0 Catalog No: AG002LBG MDL No:
Product Description
Catalog Number:
AG002LBG
Chemical Name:
1,3,2-Dioxaphosphorinane, 2-chloro-5-(1,1-dimethylethyl)-
CAS Number:
21135-08-0
Molecular Formula:
C7H14ClO2P
Molecular Weight:
196.6116
IUPAC Name:
5-tert-butyl-2-chloro-1,3,2-dioxaphosphinane
InChI:
InChI=1S/C7H14ClO2P/c1-7(2,3)6-4-9-11(8)10-5-6/h6H,4-5H2,1-3H3
InChI Key:
KOAOQFNMUIMWFU-UHFFFAOYSA-N
SMILES:
ClP1OCC(CO1)C(C)(C)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.042g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.611g/mol
Monoisotopic Mass:
196.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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