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2060057-29-4 | {5H,6H,7H-pyrrolo[1,2-a]imidazol-3-yl}methanesulfonyl chloride
CAS No: 2060057-29-4 Catalog No: AG01BW0T MDL No:MFCD30476657
Product Description
Catalog Number:
AG01BW0T
Chemical Name:
{5H,6H,7H-pyrrolo[1,2-a]imidazol-3-yl}methanesulfonyl chloride
CAS Number:
2060057-29-4
Molecular Formula:
C7H9ClN2O2S
Molecular Weight:
220.6766
MDL Number:
MFCD30476657
IUPAC Name:
6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-ylmethanesulfonyl chloride
InChI:
InChI=1S/C7H9ClN2O2S/c8-13(11,12)5-6-4-9-7-2-1-3-10(6)7/h4H,1-3,5H2
InChI Key:
ZSGUNGJNEMJRIE-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)Cc1cnc2n1CCC2
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.007g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.671g/mol
Monoisotopic Mass:
220.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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