Cas no 62790-26-5 (Benzoate-d)
Benzoate-d structure
Product Name:Benzoate-d
CAS No:62790-26-5
MF:C7H5NaO2
MW:149.133981466293
CID:502656
PubChem ID:23671533
Update Time:2025-04-19
Benzoate-d Chemical and Physical Properties
Names and Identifiers
-
- Benzoic-d5 acid, sodiumsalt (9CI)
- sodium,2,3,4,5,6-pentadeuteriobenzoate
- Benzoic acid-2,3,4,5,6-d5 sodium salt
- Sodium benzoate-d5
- Benzoate-d
- DTXSID30635460
- D99672
- MFCD01075425
- Benzoic-d5 acid,sodiumsalt(9ci)
- 62790-26-5
- HY-Y1316S
- CS-0567670
- Sodium benzoate-d5, 98 atom % D
- Benzoate-d5 (sodium)
- SCHEMBL1332445
- sodium;2,3,4,5,6-pentadeuteriobenzoate
- Sodium (~2~H_5_)benzoate
- DB-321466
-
- Inchi: 1S/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1/i1D,2D,3D,4D,5D;
- InChI Key: WXMKPNITSTVMEF-GWVWGMRQSA-M
- SMILES: [Na+].[O-]C(C1C([2H])=C([2H])C([2H])=C([2H])C=1[2H])=O
Computed Properties
- Exact Mass: 149.05000
- Monoisotopic Mass: 149.05010741g/mol
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 108
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.1?2
Experimental Properties
- Melting Point: >300?°C(lit.)
- Flash Point: 121?°C
- PSA: 40.13000
- LogP: 0.05010
Benzoate-d Security Information
- Hazard Category Code: 22-37/38-41-42/43
- Safety Instruction: S22; S26; S36/37/39; S45
-
Hazardous Material Identification:
- Risk Phrases:R22; R37/38; R41; R42/43
Benzoate-d Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | S614001-10mg |
Sodium Benzoate-d5 |
62790-26-5 | 10mg |
$ 65.00 | 2023-09-06 | ||
| TRC | S614001-50mg |
Sodium Benzoate-d5 |
62790-26-5 | 50mg |
$ 86.00 | 2023-09-06 | ||
| TRC | S614001-100mg |
Sodium Benzoate-d5 |
62790-26-5 | 100mg |
$ 109.00 | 2023-09-06 | ||
| MedChemExpress | HY-Y1316S-1mg |
Benzoate-d |
62790-26-5 | 99.50% | 1mg |
¥300 | 2024-05-24 | |
| MedChemExpress | HY-Y1316S-5mg |
Benzoate-d |
62790-26-5 | 99.50% | 5mg |
¥700 | 2024-05-24 | |
| 1PlusChem | 1P00ECCH-1mg |
SODIUM BENZOATE-D5 |
62790-26-5 | 99% | 1mg |
$69.00 | 2024-04-22 | |
| 1PlusChem | 1P00ECCH-5mg |
SODIUM BENZOATE-D5 |
62790-26-5 | 99% | 5mg |
$113.00 | 2024-04-22 | |
| MedChemExpress | HY-Y1316S-10mg |
Benzoate-d |
62790-26-5 | 99.50% | 10mg |
¥1085 | 2024-05-24 |
Benzoate-d Related Literature
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
62790-26-5 (Benzoate-d) Related Products
- 499-06-9(3,5-Dimethylbenzoic acid)
- 121-91-5(Isophthalic acid)
- 65-85-0(Benzoic acid)
- 99-94-5(4-Methylbenzoic acid)
- 499-49-0(5-Methylisophthalic acid)
- 554-95-0(Benzene-1,3,5-tricarboxylic acid)
- 619-21-6(3-Formylbenzoic acid)
- 619-04-5(3,4-Dimethylbenzoic acid)
- 582-25-2(Potassium benzoate)
- 99-04-7(3-methylbenzoic acid)
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