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13116-58-0 | 1-Propene, 1,2,3-trichloro-, (E)- (9CI)
CAS No: 13116-58-0 Catalog No: AG000VMT MDL No:
Product Description
Catalog Number:
AG000VMT
Chemical Name:
1-Propene, 1,2,3-trichloro-, (E)- (9CI)
CAS Number:
13116-58-0
Molecular Formula:
C3H3Cl3
Molecular Weight:
145.4149
IUPAC Name:
(E)-1,2,3-trichloroprop-1-ene
InChI:
InChI=1S/C3H3Cl3/c4-1-3(6)2-5/h1H,2H2/b3-1+
InChI Key:
HIILBTHBHCLUER-HNQUOIGGSA-N
SMILES:
ClC/C(=C\Cl)/Cl
UNII:
5722T13G6Z
Properties
Complexity:
57.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
143.93g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.407g/mol
Monoisotopic Mass:
143.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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