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71580-34-2 | 1H-Pyrrole, 3-ethenyl-
CAS No: 71580-34-2 Catalog No: AG005GEN MDL No:
Product Description
Catalog Number:
AG005GEN
Chemical Name:
1H-Pyrrole, 3-ethenyl-
CAS Number:
71580-34-2
Molecular Formula:
C6H7N
Molecular Weight:
93.1265
IUPAC Name:
3-ethenyl-1H-pyrrole
InChI:
InChI=1S/C6H7N/c1-2-6-3-4-7-5-6/h2-5,7H,1H2
InChI Key:
PLXFPCQGPZECLF-UHFFFAOYSA-N
SMILES:
C=Cc1c[nH]cc1
Properties
Complexity:
68.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
93.058g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
93.129g/mol
Monoisotopic Mass:
93.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Improved preparation of sulfur substituted 3-vinylpyrrole and its application to the syntheses of chuangxinmycin derivatives. | Chemical & pharmaceutical bulletin 20010901 |
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