Cas no 80610-53-3 (Benzoyl chloride,4-(aminomethyl)-)
80610-53-3 structure
Product Name:Benzoyl chloride,4-(aminomethyl)-
CAS No:80610-53-3
MF:C8H8ClNO
MW:169.608221054077
CID:707734
PubChem ID:19604111
Update Time:2025-04-19
Benzoyl chloride,4-(aminomethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl chloride,4-(aminomethyl)-
- 4-(aminomethyl)benzoyl chloride
- Benzoyl chloride, 4-(aminomethyl)- (9CI)
- AKOS006294778
- 80610-53-3
- SCHEMBL8021407
- DTXSID80598990
- Benzoyl chloride,4-(aminomethyl)-(9ci)
-
- Inchi： 1S/C8H8ClNO/c9-8(11)7-3-1-6(5-10)2-4-7/h1-4H,5,10H2
- InChI Key： QXLIYRDGWPUNTD-UHFFFAOYSA-N
- SMILES： ClC(C1C=CC(=CC=1)CN)=O
Computed Properties
- Exact Mass: 169.0294416g/mol
- Monoisotopic Mass: 169.0294416g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 141
- 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: 1.7
- Topological Polar Surface Area: 43.1?2
Benzoyl chloride,4-(aminomethyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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