Cas no 154519-62-7 (Benzenamine, 2-chloro-N-2-propynyl- (9CI))
154519-62-7 structure
Product Name:Benzenamine, 2-chloro-N-2-propynyl- (9CI)
CAS No:154519-62-7
MF:C9H8ClN
MW:165.619521141052
CID:106607
PubChem ID:10975840
Update Time:2025-04-18
Benzenamine, 2-chloro-N-2-propynyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 2-chloro-N-2-propynyl- (9CI)
- 2-chloro-N-prop-2-ynylaniline
- (2-Chloro-phenyl)-prop-2-ynyl-amine
- 154519-62-7
- AKOS009046961
- 2-chloro-N-propargylaniline
- DTXSID50450379
- 2-Chloro-N-(prop-2-yn-1-yl)aniline
- SCHEMBL25001918
-
- Inchi： 1S/C9H8ClN/c1-2-7-11-9-6-4-3-5-8(9)10/h1,3-6,11H,7H2
- InChI Key： DJMJZIPKJLFZGW-UHFFFAOYSA-N
- SMILES： ClC1C=CC=CC=1NCC#C
Computed Properties
- Exact Mass: 165.03464
- Monoisotopic Mass: 165.0345270g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 158
- 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: 2.6
- Topological Polar Surface Area: 12?2
Experimental Properties
- PSA: 12.03
Benzenamine, 2-chloro-N-2-propynyl- (9CI) Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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