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245744-10-9 | 1H-Imidazole, 5-(6,7-dihydrobenzo[b]thien-4-yl)-
CAS No: 245744-10-9 Catalog No: AG002OMX MDL No:MFCD27947988
Product Description
Catalog Number:
AG002OMX
Chemical Name:
1H-Imidazole, 5-(6,7-dihydrobenzo[b]thien-4-yl)-
CAS Number:
245744-10-9
Molecular Formula:
C11H10N2S
Molecular Weight:
202.2755
MDL Number:
MFCD27947988
IUPAC Name:
5-(6,7-dihydro-1-benzothiophen-4-yl)-1H-imidazole
InChI:
InChI=1S/C11H10N2S/c1-2-8(10-6-12-7-13-10)9-4-5-14-11(9)3-1/h2,4-7H,1,3H2,(H,12,13)
InChI Key:
BAADWHDQAKDYLX-UHFFFAOYSA-N
SMILES:
c1ncc([nH]1)C1=CCCc2c1ccs2
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.275g/mol
Monoisotopic Mass:
202.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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