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313508-71-3 | 4-(5-Amino-benzoimidazol-1-yl)-butan-1-ol
CAS No: 313508-71-3 Catalog No: AG01FBQB MDL No:
Product Description
Catalog Number:
AG01FBQB
Chemical Name:
4-(5-Amino-benzoimidazol-1-yl)-butan-1-ol
CAS Number:
313508-71-3
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
IUPAC Name:
4-(5-aminobenzimidazol-1-yl)butan-1-ol
InChI:
InChI=1S/C11H15N3O/c12-9-3-4-11-10(7-9)13-8-14(11)5-1-2-6-15/h3-4,7-8,15H,1-2,5-6,12H2
InChI Key:
VQGIKPVTYFAATG-UHFFFAOYSA-N
SMILES:
OCCCCn1cnc2c1ccc(c2)N
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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