Cas no 41240-82-8 (N-(2-butoxyphenyl)-2-chloroacetamide)
41240-82-8 structure
Product Name:N-(2-butoxyphenyl)-2-chloroacetamide
CAS No:41240-82-8
MF:C12H16ClNO2
MW:241.713942527771
CID:926764
PubChem ID:295964
Update Time:2025-04-19
N-(2-butoxyphenyl)-2-chloroacetamide Chemical and Physical Properties
Names and Identifiers
-
- N-(2-butoxyphenyl)-2-chloroacetamide
- AC1L6PBP
- AG-F-46806
- Chlor-essigsaeure-(2-butoxy-anilid)
- chloro-acetic acid-(2-butoxy-anilide)
- CTK4I4495
- N-(2-BUTOXYPHENYL)-2-CHLORO-ACETAMIDE
- NSC165633
- NSC 165633
- DTXSID50304404
- NSC-165633
- 41240-82-8
- AKOS002954677
-
- Inchi： 1S/C12H16ClNO2/c1-2-3-8-16-11-7-5-4-6-10(11)14-12(15)9-13/h4-7H,2-3,8-9H2,1H3,(H,14,15)
- InChI Key： KJLAOPIUOGHMOW-UHFFFAOYSA-N
- SMILES： ClCC(NC1C=CC=CC=1OCCCC)=O
Computed Properties
- Exact Mass: 241.08708
- Monoisotopic Mass: 241.0869564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 211
- 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: 3
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 38.33
- LogP: 3.11580
N-(2-butoxyphenyl)-2-chloroacetamide Related Literature
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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