Cas no 234751-00-9 (Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate)
![Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate structure](https://ossimg.kuujia.com/scimg/235000/234751-00-9x500.png)
234751-00-9 structure
Product Name:Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate
CAS No:234751-00-9
MF:C12H16N2O4
MW:252.266443252563
CID:2837042
PubChem ID:67334709
Update Time:2025-04-21
Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL2251103
- DTXSID70736844
- 4-Isobutylamino-3-nitro-benzoic acid methyl ester
- Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate
- 234751-00-9
- OCDFGCSEERXHCB-UHFFFAOYSA-N
- Methyl 4-(isobutylamino)-3-nitrobenzoate, AldrichCPR
- Methyl 4-(isobutylamino)-3-nitrobenzoate
-
- Inchi： 1S/C12H16N2O4/c1-8(2)7-13-10-5-4-9(12(15)18-3)6-11(10)14(16)17/h4-6,8,13H,7H2,1-3H3
- InChI Key： OCDFGCSEERXHCB-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=CC(=C(C=1)[N+](=O)[O-])NCC(C)C)=O
Computed Properties
- Exact Mass: 252.11100700Da
- Monoisotopic Mass: 252.11100700Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 301
- 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: 3.5
- Topological Polar Surface Area: 84.2?2
Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate Related Literature
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
234751-00-9 (Methyl 4-[(2-methylpropyl)amino]-3-nitrobenzoate) Related Products
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
鉅瀾化工科技(青島)有限公司
Gold Member
Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
