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147094-02-8 | 2-Pyrimidinamine, N-(2-thienylmethylene)-
CAS No: 147094-02-8 Catalog No: AG001EL4 MDL No:
Product Description
Catalog Number:
AG001EL4
Chemical Name:
2-Pyrimidinamine, N-(2-thienylmethylene)-
CAS Number:
147094-02-8
Molecular Formula:
C9H7N3S
Molecular Weight:
189.2370
IUPAC Name:
N-pyrimidin-2-yl-1-thiophen-2-ylmethanimine
InChI:
InChI=1S/C9H7N3S/c1-3-8(13-6-1)7-12-9-10-4-2-5-11-9/h1-7H
InChI Key:
MEEZEHIMSIXUAT-UHFFFAOYSA-N
SMILES:
c1cnc(nc1)N=Cc1cccs1
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.236g/mol
Monoisotopic Mass:
189.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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