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99955-73-4 | Pyrrolo[2,1-b]thiazole-5-carbonylchloride, 2,3-dihydro-
CAS No: 99955-73-4 Catalog No: AG003VOD MDL No:
Product Description
Catalog Number:
AG003VOD
Chemical Name:
Pyrrolo[2,1-b]thiazole-5-carbonylchloride, 2,3-dihydro-
CAS Number:
99955-73-4
Molecular Formula:
C7H6ClNOS
Molecular Weight:
187.6466
IUPAC Name:
2,3-dihydropyrrolo[2,1-b][1,3]thiazole-5-carbonyl chloride
InChI:
InChI=1S/C7H6ClNOS/c8-7(10)5-1-2-6-9(5)3-4-11-6/h1-2H,3-4H2
InChI Key:
PJUYXELGITWQHV-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc2n1CCS2
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.986g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.641g/mol
Monoisotopic Mass:
186.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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