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313968-53-5 | 3-(1H-Naphtho[2,3-d]imidazol-2-yl)-propan-1-ol
CAS No: 313968-53-5 Catalog No: AG01EUVM MDL No:
Product Description
Catalog Number:
AG01EUVM
Chemical Name:
3-(1H-Naphtho[2,3-d]imidazol-2-yl)-propan-1-ol
CAS Number:
313968-53-5
Molecular Formula:
C14H14N2O
Molecular Weight:
226.2738
IUPAC Name:
3-(1H-benzo[f]benzimidazol-2-yl)propan-1-ol
InChI:
InChI=1S/C14H14N2O/c17-7-3-6-14-15-12-8-10-4-1-2-5-11(10)9-13(12)16-14/h1-2,4-5,8-9,17H,3,6-7H2,(H,15,16)
InChI Key:
HEWMZTQOEWFDNV-UHFFFAOYSA-N
SMILES:
OCCCc1nc2c([nH]1)cc1c(c2)cccc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.279g/mol
Monoisotopic Mass:
226.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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