Cas no 219685-78-6 (Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester)
219685-78-6 structure
Product Name:Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester
CAS No:219685-78-6
MF:C8H6Cl2O3
MW:221.037440776825
CID:1405149
PubChem ID:22999117
Update Time:2025-07-13
Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester
- 219685-78-6
- DTXSID701223907
- CS-0436736
- SCHEMBL2648411
- methyl 2,3-dichloro-4-hydroxybenzoate
-
- Inchi： 1S/C8H6Cl2O3/c1-13-8(12)4-2-3-5(11)7(10)6(4)9/h2-3,11H,1H3
- InChI Key： JKUMRRWTUNVWJP-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C=CC=1C(=O)OC)O)Cl
Computed Properties
- Exact Mass: 219.96948
- Monoisotopic Mass: 219.9693994g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 198
- 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: 2.7
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A015013090-250mg |
Methyl 2,3-dichloro-4-hydroxybenzoate |
219685-78-6 | 97% | 250mg |
$484.80 | 2023-09-02 | |
| Alichem | A015013090-500mg |
Methyl 2,3-dichloro-4-hydroxybenzoate |
219685-78-6 | 97% | 500mg |
$790.55 | 2023-09-02 | |
| Alichem | A015013090-1g |
Methyl 2,3-dichloro-4-hydroxybenzoate |
219685-78-6 | 97% | 1g |
$1549.60 | 2023-09-02 |
Benzoic acid, 2,3-dichloro-4-hydroxy-, methyl ester Related Literature
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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