Cas no 2906-33-4 (Benzoic acid, 3-amino-,ion(1-))
2906-33-4 structure
Product Name:Benzoic acid, 3-amino-,ion(1-)
CAS No:2906-33-4
MF:C7H6NO2
MW:136.128041744232
CID:278487
PubChem ID:3014145
Update Time:2025-04-19
Benzoic acid, 3-amino-,ion(1-) Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3-amino-,ion(1-)
- 3-Aminobenzoate
- Benzoicacid, m-amino-, ion(1-) (8CI)
- m-Aminobenzoate
- m-Aminobenzoate anion
- XFDUHJPVQKIXHO-UHFFFAOYSA-M
- BDBM50340077
- 3fhb
- 3fqa
- CHEMBL1762659
- Benzoic acid, 3-amino-, ion(1-)
- 2906-33-4
- Q27113973
- CHEBI:30761
- 3-aminobenzoic acid, ion(1-)
-
- Inchi： 1S/C7H7NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H,9,10)/p-1
- InChI Key： XFDUHJPVQKIXHO-UHFFFAOYSA-M
- SMILES： [O-]C(C1C=CC=C(C=1)N)=O
Computed Properties
- Exact Mass: 136.04
- Monoisotopic Mass: 136.04
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 130
- 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: 0.8
- Topological Polar Surface Area: 66.2?2
Experimental Properties
- Melting Point: 173.0 °C
Benzoic acid, 3-amino-,ion(1-) Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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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
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
2906-33-4 (Benzoic acid, 3-amino-,ion(1-)) Related Products
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