Cas no 129082-78-6 (Benzoic acid, 4-hydrazino-, butyl ester (9CI))
129082-78-6 structure
Product Name:Benzoic acid, 4-hydrazino-, butyl ester (9CI)
CAS No:129082-78-6
MF:C11H16N2O2
MW:208.256942749023
CID:1023157
PubChem ID:45089817
Update Time:2025-04-20
Benzoic acid, 4-hydrazino-, butyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-hydrazino-, butyl ester (9CI)
- Butyl 4-hydrazinobenzoate
- 129082-78-6
-
- Inchi： 1S/C11H16N2O2/c1-2-3-8-15-11(14)9-4-6-10(13-12)7-5-9/h4-7,13H,2-3,8,12H2,1H3
- InChI Key： ZTCJMKUOBMZFDN-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(=CC=1)NN)=O)CCCC
Computed Properties
- Exact Mass: 208.12128
- Monoisotopic Mass: 208.121
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 189
- 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: 3.2
- Topological Polar Surface Area: 64.4A^2
Experimental Properties
- PSA: 64.35
Benzoic acid, 4-hydrazino-, butyl ester (9CI) Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
129082-78-6 (Benzoic acid, 4-hydrazino-, butyl ester (9CI)) Related Products
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