Cas no 1394839-18-9 (2-Amino-4-chlorobenzoyl chloride hydrochloride)
1394839-18-9 structure
Product Name:2-Amino-4-chlorobenzoyl chloride hydrochloride
CAS No:1394839-18-9
MF:C7H6Cl3NO
MW:226.487638950348
CID:2194112
Update Time:2023-08-07
2-Amino-4-chlorobenzoyl chloride hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 2-Amino-4-chlorobenzoyl chloride hydrochloride
- 2-amino-4-chlorobenzoylchloride hydrochloride
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- Inchi： 1S/C7H5Cl2NO.ClH/c8-4-1-2-5(7(9)11)6(10)3-4;/h1-3H,10H2;1H
- InChI Key： NCXLKVIHWABABH-UHFFFAOYSA-N
- SMILES： ClC1C=CC(C(=O)Cl)=C(C=1)N.Cl
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 163
- Topological Polar Surface Area: 43.1
2-Amino-4-chlorobenzoyl chloride hydrochloride Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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