Cas no 153893-09-5 (1H-Benzimidazole-1-propanal)
1H-Benzimidazole-1-propanal structure
Product Name:1H-Benzimidazole-1-propanal
CAS No:153893-09-5
MF:C10H10N2O
MW:174.199202060699
CID:106382
PubChem ID:22018549
Update Time:2025-04-18
1H-Benzimidazole-1-propanal Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-1-propanal
- 3-(benzimidazol-1-yl)propanal
- 1H-Benzimidazole-1-propanal(9CI)
- 1-(3-oxopropyl)benzimidazole
- 3-(1H-Benzimidazol-1-yl)propanal
- DTXSID50621567
- AKOS012338633
- SCHEMBL4070365
- 153893-09-5
- HRUAWKZCCFADRR-UHFFFAOYSA-N
-
- Inchi： 1S/C10H10N2O/c13-7-3-6-12-8-11-9-4-1-2-5-10(9)12/h1-2,4-5,7-8H,3,6H2
- InChI Key： HRUAWKZCCFADRR-UHFFFAOYSA-N
- SMILES： O=CCCN1C=NC2C=CC=CC1=2
Computed Properties
- Exact Mass: 174.0794
- Monoisotopic Mass: 174.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 184
- 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: 0.8
- Topological Polar Surface Area: 34.9?2
Experimental Properties
- PSA: 34.89
1H-Benzimidazole-1-propanal Related Literature
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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