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126696-78-4 | 1,2-Propadiene, 1-[(chloromethyl)sulfonyl]-
CAS No: 126696-78-4 Catalog No: AG000T4L MDL No:
Product Description
Catalog Number:
AG000T4L
Chemical Name:
1,2-Propadiene, 1-[(chloromethyl)sulfonyl]-
CAS Number:
126696-78-4
Molecular Formula:
C4H5ClO2S
Molecular Weight:
152.5993
IUPAC Name:
1-(chloromethylsulfonyl)propa-1,2-diene
InChI:
InChI=1S/C4H5ClO2S/c1-2-3-8(6,7)4-5/h3H,1,4H2
InChI Key:
XLJGOMXGCTZXDZ-UHFFFAOYSA-N
SMILES:
ClCS(=O)(=O)C=C=C
Properties
Complexity:
193
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.97g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.592g/mol
Monoisotopic Mass:
151.97g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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