Cas no 58123-68-5 (Benzoic acid, 3,5-dicyano-)
Benzoic acid, 3,5-dicyano- structure
Product Name:Benzoic acid, 3,5-dicyano-
CAS No:58123-68-5
MF:C9H4N2O2
MW:172.140261650085
CID:343039
PubChem ID:21942567
Update Time:2025-04-19
Benzoic acid, 3,5-dicyano- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3,5-dicyano-
- 3,5-dicyanobenzoic acid
- PSGADGLETMZWOY-UHFFFAOYSA-N
- 58123-68-5
- AB76518
- AKOS033927995
- DTXSID80620508
- Z1262534813
- SCHEMBL2170685
-
- Inchi： 1S/C9H4N2O2/c10-4-6-1-7(5-11)3-8(2-6)9(12)13/h1-3H,(H,12,13)
- InChI Key： PSGADGLETMZWOY-UHFFFAOYSA-N
- SMILES： OC(C1C=C(C#N)C=C(C#N)C=1)=O
Computed Properties
- Exact Mass: 172.02732
- Monoisotopic Mass: 172.027277375g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 282
- 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: 1
- Topological Polar Surface Area: 84.9?2
Experimental Properties
- Density: 1.42±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Very slightly soluble (0.4 g/l) (25 o C),
- PSA: 84.88
Benzoic acid, 3,5-dicyano- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1637596-250mg |
3,5-Dicyanobenzoic acid |
58123-68-5 | 98% | 250mg |
￥6561.00 | 2024-05-08 |
Benzoic acid, 3,5-dicyano- Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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