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1785503-68-5 | 2-methyl-5H,6H,7H-pyrrolo[1,2-a]imidazole-3-sulfonyl chloride
CAS No: 1785503-68-5 Catalog No: AG01B7R3 MDL No:MFCD28145536
Product Description
Catalog Number:
AG01B7R3
Chemical Name:
2-methyl-5H,6H,7H-pyrrolo[1,2-a]imidazole-3-sulfonyl chloride
CAS Number:
1785503-68-5
Molecular Formula:
C7H9ClN2O2S
Molecular Weight:
220.6766
MDL Number:
MFCD28145536
IUPAC Name:
2-methyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-3-sulfonyl chloride
InChI:
InChI=1S/C7H9ClN2O2S/c1-5-7(13(8,11)12)10-4-2-3-6(10)9-5/h2-4H2,1H3
InChI Key:
ACVQSSGCZAFVJE-UHFFFAOYSA-N
SMILES:
Cc1nc2n(c1S(=O)(=O)Cl)CCC2
Properties
Complexity:
300
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:
1
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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