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22945-76-2 | Phosphoric acid, bis(2,3-dibromopropyl) 2,3-dichloropropyl ester
CAS No: 22945-76-2 Catalog No: AG002LMZ MDL No:
Product Description
Catalog Number:
AG002LMZ
Chemical Name:
Phosphoric acid, bis(2,3-dibromopropyl) 2,3-dichloropropyl ester
CAS Number:
22945-76-2
Molecular Formula:
C9H15Br4Cl2O4P
Molecular Weight:
608.7088
IUPAC Name:
bis(2,3-dibromopropyl) 2,3-dichloropropyl phosphate
InChI:
InChI=1S/C9H15Br4Cl2O4P/c10-1-7(12)4-17-20(16,18-5-8(13)2-11)19-6-9(15)3-14/h7-9H,1-6H2
InChI Key:
RAYIMXZLSRHMTK-UHFFFAOYSA-N
SMILES:
ClCC(COP(=O)(OCC(CBr)Br)OCC(CBr)Br)Cl
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
607.678g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
608.705g/mol
Monoisotopic Mass:
603.682g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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