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65282-78-2 | Thiopropylimidazole
CAS No: 65282-78-2 Catalog No: AG00E8ZX MDL No:
Product Description
Catalog Number:
AG00E8ZX
Chemical Name:
Thiopropylimidazole
CAS Number:
65282-78-2
IUPAC Name:
3-(1H-imidazol-2-yl)propanethial
InChI:
InChI=1S/C6H8N2S/c9-5-1-2-6-7-3-4-8-6/h3-5H,1-2H2,(H,7,8)
InChI Key:
KOLCACMKMAFWFQ-UHFFFAOYSA-N
Properties
Complexity:
95.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.041g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.204g/mol
Monoisotopic Mass:
140.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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