Cas no 175357-61-6 (1-Benzyl-3-butylpiperazine)
1-Benzyl-3-butylpiperazine structure
Product Name:1-Benzyl-3-butylpiperazine
CAS No:175357-61-6
MF:C15H24N2
MW:232.364463806152
CID:112015
PubChem ID:19353079
Update Time:2025-04-18
1-Benzyl-3-butylpiperazine Chemical and Physical Properties
Names and Identifiers
-
- 1-Benzyl-3-butylpiperazine
- (S)-1-benzyl-3-butylpiperazine
- 1‐BENZYL‐3‐BUTYLPIPERAZINE
- Piperazine,3-butyl-1-(phenylmethyl)-, (3S)-
- (3S)-1-benzyl-3-butylpiperazine
- (S)-3-Butyl-1-(phenylmethyl)piperazine
- 186412-45-3
- FT-0710076
- SCHEMBL8152771
- FT-0770438
- A26349
- DALAPON-METHYLESTER
- 175357-61-6
- AKOS022181229
- FT-0728933
- DTXSID00938657
-
- Inchi: 1S/C15H24N2/c1-2-3-9-15-13-17(11-10-16-15)12-14-7-5-4-6-8-14/h4-8,15-16H,2-3,9-13H2,1H3
- InChI Key: XESDITBVSGTNKQ-UHFFFAOYSA-N
- SMILES: N1(CC2C=CC=CC=2)CCNC(CCCC)C1
Computed Properties
- Exact Mass: 232.19412
- Monoisotopic Mass: 232.193948774g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 199
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 15.3?2
Experimental Properties
- Density: 0.958
- Boiling Point: 332 oC
- Flash Point: 119 oC
- PSA: 15.27
1-Benzyl-3-butylpiperazine Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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