Cas no 885268-91-7 (Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI))
885268-91-7 structure
Product Name:Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI)
CAS No:885268-91-7
MF:C12H26N2O2
MW:230.347043514252
CID:710641
PubChem ID:90477244
Update Time:2025-04-19
Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
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- Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI)
- tert-butyl 3-aminopropyl(butyl)carbamate
- Tert-butyl 3-aminopropyl(butylcarbamate
- 885268-91-7
-
- Inchi： 1S/C12H26N2O2/c1-5-6-9-14(10-7-8-13)11(15)16-12(2,3)4/h5-10,13H2,1-4H3
- InChI Key： NTOQTDPBGNSKAN-UHFFFAOYSA-N
- SMILES： O(C(N(CCCN)CCCC)=O)C(C)(C)C
Computed Properties
- Exact Mass: 230.199428076g/mol
- Monoisotopic Mass: 230.199428076g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 200
- 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: 1.8
- Topological Polar Surface Area: 55.6?2
Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI) 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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
885268-91-7 (Carbamic acid,(3-aminopropyl)butyl-, 1,1-dimethylethyl ester (9CI)) Related Products
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