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137352-77-3 | Benzenamine, 2-methyl-5-(1H-pyrrol-1-yl)-
CAS No: 137352-77-3 Catalog No: AG001363 MDL No:MFCD03725037
Product Description
Catalog Number:
AG001363
Chemical Name:
Benzenamine, 2-methyl-5-(1H-pyrrol-1-yl)-
CAS Number:
137352-77-3
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
MDL Number:
MFCD03725037
IUPAC Name:
2-methyl-5-pyrrol-1-ylaniline
InChI:
InChI=1S/C11H12N2/c1-9-4-5-10(8-11(9)12)13-6-2-3-7-13/h2-8H,12H2,1H3
InChI Key:
NWWCJFJCEIFBAZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1N)n1cccc1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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