Cas no 791039-94-6 (Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro-)
![Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro- structure](https://ossimg.kuujia.com/scimg/791500/791039-94-6x500.png)
791039-94-6 structure
Product Name:Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro-
CAS No:791039-94-6
MF:C9H10N2O4
MW:210.186702251434
CID:562299
PubChem ID:12109160
Update Time:2025-06-30
Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro-
- BENZOIC ACID, 4-(1-AMINOETHYL)-3-NITRO-, (R)- (9CI)
- 4-[(1R)-1-aMinoethyl]-3-nitro
- Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro
- MFCD11042404
- (R)-4-(1-Aminoethyl)-3-nitrobenzoic acid
- 791039-94-6
- Benzoic acid,4-(1-aminoethyl)-3-nitro-,(R)-
- 4-[(1R)-1-Aminoethyl]-3-nitrobenzoic acid
-
- Inchi： 1S/C9H10N2O4/c1-5(10)7-3-2-6(9(12)13)4-8(7)11(14)15/h2-5H,10H2,1H3,(H,12,13)/t5-/m1/s1
- InChI Key： KSBVDNILPMPKSN-RXMQYKEDSA-N
- SMILES： [O-][N+](C1C=C(C(=O)O)C=CC=1[C@@H](C)N)=O
Computed Properties
- Exact Mass: 210.06400
- Monoisotopic Mass: 210.06405680g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 263
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.7
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 109.14000
- LogP: 2.53620
Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM590446-1g |
(R)-4-(1-aminoethyl)-3-nitrobenzoic acid |
791039-94-6 | 95%+ | 1g |
$1960 | 2022-06-10 | |
| Chemenu | CM590446-5g |
(R)-4-(1-aminoethyl)-3-nitrobenzoic acid |
791039-94-6 | 95%+ | 5g |
$5880 | 2022-06-10 |
Benzoic acid,4-[(1R)-1-aminoethyl]-3-nitro- Related Literature
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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