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18963-00-3 | Propane, 1,2,3-trichloro-2-(chloromethyl)-
CAS No: 18963-00-3 Catalog No: AG002DTW MDL No:
Product Description
Catalog Number:
AG002DTW
Chemical Name:
Propane, 1,2,3-trichloro-2-(chloromethyl)-
CAS Number:
18963-00-3
Molecular Formula:
C4H6Cl4
Molecular Weight:
195.9024
IUPAC Name:
1,2,3-trichloro-2-(chloromethyl)propane
InChI:
InChI=1S/C4H6Cl4/c5-1-4(8,2-6)3-7/h1-3H2
InChI Key:
CFLWPMRPCYBIIS-UHFFFAOYSA-N
SMILES:
ClCC(CCl)(CCl)Cl
NSC Number:
71135
Properties
Complexity:
50.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.919g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.892g/mol
Monoisotopic Mass:
193.922g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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