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18351-36-5 | Phosphorodichloridic acid, 4-(1,1-dimethylethyl)phenyl ester
CAS No: 18351-36-5 Catalog No: AG0027NX MDL No:
Product Description
Catalog Number:
AG0027NX
Chemical Name:
Phosphorodichloridic acid, 4-(1,1-dimethylethyl)phenyl ester
CAS Number:
18351-36-5
Molecular Formula:
C10H13Cl2O2P
Molecular Weight:
267.0888
IUPAC Name:
1-tert-butyl-4-dichlorophosphoryloxybenzene
InChI:
InChI=1S/C10H13Cl2O2P/c1-10(2,3)8-4-6-9(7-5-8)14-15(11,12)13/h4-7H,1-3H3
InChI Key:
LYGYPAUNHUFEHM-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)OP(=O)(Cl)Cl)(C)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.003g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.086g/mol
Monoisotopic Mass:
266.003g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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