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1048914-18-6 | 4-Iodo-1H-pyrrole-2-carbohydrazide
CAS No: 1048914-18-6 Catalog No: AG00HAFH MDL No:MFCD11100249
Product Description
Catalog Number:
AG00HAFH
Chemical Name:
4-Iodo-1H-pyrrole-2-carbohydrazide
CAS Number:
1048914-18-6
Molecular Formula:
C5H6IN3O
Molecular Weight:
251.0251
MDL Number:
MFCD11100249
IUPAC Name:
4-iodo-1H-pyrrole-2-carbohydrazide
InChI:
InChI=1S/C5H6IN3O/c6-3-1-4(8-2-3)5(10)9-7/h1-2,8H,7H2,(H,9,10)
InChI Key:
PPHKIIUANOYQMC-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc(c[nH]1)I
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.956g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
251.027g/mol
Monoisotopic Mass:
250.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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