Home Halogens 1,3-dichloropropan-2-yl chloroformate

1,3-dichloropropan-2-yl chloroformate

CAS No.:
55183-48-7
Catalog Number:
AG01A9RN
Molecular Formula:
C4H5Cl3O2
Molecular Weight:
191.4403
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Product Description
Catalog Number:
AG01A9RN
Chemical Name:
1,3-dichloropropan-2-yl chloroformate
CAS Number:
55183-48-7
Molecular Formula:
C4H5Cl3O2
Molecular Weight:
191.4403
MDL Number:
MFCD16622204
IUPAC Name:
1,3-dichloropropan-2-yl carbonochloridate
InChI:
InChI=1S/C4H5Cl3O2/c5-1-3(2-6)9-4(7)8/h3H,1-2H2
InChI Key:
WPRAJCBWNFZEAS-UHFFFAOYSA-N
SMILES:
ClCC(OC(=O)Cl)CCl
Properties
Complexity:
91.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.936g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.432g/mol
Monoisotopic Mass:
189.936g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties