Cas no 31035-84-4 (Carbamic acid,dimethyl-, 1,4-butanediyl ester (9CI))
31035-84-4 structure
Product Name:Carbamic acid,dimethyl-, 1,4-butanediyl ester (9CI)
CAS No:31035-84-4
MF:C10H20N2O4
MW:232.276803016663
CID:321149
PubChem ID:351710
Update Time:2025-04-19
Carbamic acid,dimethyl-, 1,4-butanediyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4-(dimethylcarbamoyloxy)butyl N,N-dimethylcarbamate
- Carbamic acid,dimethyl-, 1,4-butanediyl ester (9CI)
- DTXSID50326025
- NSC-522783
- NSC522783
- 31035-84-4
-
- Inchi： 1S/C10H20N2O4/c1-11(2)9(13)15-7-5-6-8-16-10(14)12(3)4/h5-8H2,1-4H3
- InChI Key： HRAXWHJAYIFPSW-UHFFFAOYSA-N
- SMILES： O(C(N(C)C)=O)CCCCOC(N(C)C)=O
Computed Properties
- Exact Mass: 232.1424
- Monoisotopic Mass: 232.14230712g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 205
- 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: 0.7
- Topological Polar Surface Area: 59.1?2
Experimental Properties
- PSA: 59.08
Carbamic acid,dimethyl-, 1,4-butanediyl ester (9CI) Related Literature
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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