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1200113-99-0 | 1H-Benzimidazole, 5-bromo-1-propyl-
CAS No: 1200113-99-0 Catalog No: AG000Q2J MDL No:MFCD21609570
Product Description
Catalog Number:
AG000Q2J
Chemical Name:
1H-Benzimidazole, 5-bromo-1-propyl-
CAS Number:
1200113-99-0
Molecular Formula:
C10H11BrN2
Molecular Weight:
239.1117
MDL Number:
MFCD21609570
IUPAC Name:
5-bromo-1-propylbenzimidazole
InChI:
InChI=1S/C10H11BrN2/c1-2-5-13-7-12-9-6-8(11)3-4-10(9)13/h3-4,6-7H,2,5H2,1H3
InChI Key:
STSGZOPADMCOGE-UHFFFAOYSA-N
SMILES:
CCCn1cnc2c1ccc(c2)Br
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.011g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.116g/mol
Monoisotopic Mass:
238.011g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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