Cas no 107726-25-0 (1H-Benzimidazol-2-amine,6-propyl-)
107726-25-0 structure
Product Name:1H-Benzimidazol-2-amine,6-propyl-
CAS No:107726-25-0
MF:C10H13N3
MW:175.230321645737
CID:127666
PubChem ID:19017770
Update Time:2025-04-18
1H-Benzimidazol-2-amine,6-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazol-2-amine,6-propyl-
- 1H-Benzimidazol-2-amine,5-propyl-(9CI)
- SCHEMBL5679917
- DTXSID101301812
- SCHEMBL18428682
- 6-propyl-1H-benzimidazol-2-amine
- 5-propyl-1H-benzo[d]imidazol-2-amine
- 107726-25-0
-
- Inchi： 1S/C10H13N3/c1-2-3-7-4-5-8-9(6-7)13-10(11)12-8/h4-6H,2-3H2,1H3,(H3,11,12,13)
- InChI Key： AMBQHJGKBIVLRG-UHFFFAOYSA-N
- SMILES： N1C(N)=NC2=CC=C(C=C12)CCC
Computed Properties
- Exact Mass: 175.11109
- Monoisotopic Mass: 175.111
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 172
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 54.7A^2
Experimental Properties
- PSA: 54.7
1H-Benzimidazol-2-amine,6-propyl- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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