Cas no 7461-49-6 ( )
structure
Product Name:
CAS No:7461-49-6
MF:C3H8ClNO
MW:109.554719924927
CID:979469
PubChem ID:21878349
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- propanamide,hydrochloride
- NSC403511
- NSC-403511
- 7461-49-6
- SCHEMBL414999
- DTXSID90619281
- propionamide hydrochloride
- VHWJSJBTUWUEAL-UHFFFAOYSA-N
- ethylformamidate hydrochloride
- Propanamide--hydrogen chloride (1/1)
-
-
- Inchi： 1S/C3H7NO.ClH/c1-2-3(4)5;/h2H2,1H3,(H2,4,5);1H
- InChI Key： VHWJSJBTUWUEAL-UHFFFAOYSA-N
- SMILES： Cl.O=C(CC)N
Computed Properties
- Exact Mass: 109.02954
- Monoisotopic Mass: 109.0294416g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 6
- Rotatable Bond Count: 1
- Complexity: 42.2
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 43.1?2
Experimental Properties
- PSA: 43.09
- LogP: 1.38400
Related Literature
-
Veluru Jagadeesh babu,Sesha Vempati RSC Adv., 2015,5, 66367-66375
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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