Cas no 90429-36-0 (Carbamic acid, (4-nitrophenyl)-, pentyl ester)
90429-36-0 structure
Product Name:Carbamic acid, (4-nitrophenyl)-, pentyl ester
CAS No:90429-36-0
MF:C12H16N2O4
MW:252.266443252563
CID:788784
PubChem ID:522949
Update Time:2025-04-19
Carbamic acid, (4-nitrophenyl)-, pentyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, (4-nitrophenyl)-, pentyl ester
- pentyl N-(4-nitrophenyl)carbamate
- 90429-36-0
- SCHEMBL8664039
- p-Nitro carbanilic acid, n-pentyl ester
- DTXSID80335120
-
- Inchi: 1S/C12H16N2O4/c1-2-3-4-9-18-12(15)13-10-5-7-11(8-6-10)14(16)17/h5-8H,2-4,9H2,1H3,(H,13,15)
- InChI Key: PAXRUOYAZXQGOI-UHFFFAOYSA-N
- SMILES: O(C(NC1C=CC(=CC=1)[N+](=O)[O-])=O)CCCCC
Computed Properties
- Exact Mass: 252.11100700g/mol
- Monoisotopic Mass: 252.11100700g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 270
- 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: 3.6
- Topological Polar Surface Area: 84.2?2
Carbamic acid, (4-nitrophenyl)-, pentyl ester Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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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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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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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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
90429-36-0 (Carbamic acid, (4-nitrophenyl)-, pentyl ester) Related Products
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