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Basic information
- CAS
68807-83-0- Standard SMILES
NCC(O)c1ccc(O)c(C(N)=O)c1- InChIKey
WOEISFSYHVAQTR-UHFFFAOYSA-N- Molecular formula
- C9H12N2O3
- Average molar mass
- 196.2 g/mol
- Monoisotopic mass
- 196.08479224
Names & identifiers
- Preferred name
- 5-(2-Amino-1-hydroxyethyl)-2-hydroxybenzamide
- IUPAC
- 5-(2-amino-1-hydroxyethyl)-2-hydroxybenzamide
- English name
- Benzamide, 5-(2-amino-1-hydroxyethyl)-2-hydroxy-
- Molecular formula
- C9H12N2O3
- Molecular weight
- 196.2
Names & synonyms
68807-83-05-(2-Amino-1-hydroxyethyl)-2-hydroxybenzamideDTXSID80574370RefChem:299372DTXCID00525142Benzamide, 5-(2-amino-1-hydroxyethyl)-2-hydroxy-Labetalol EP Impurity D5-(2-amino-1-hydroxyethyl)salicylamideSCHEMBL9135589SCHEMBL30883921WOEISFSYHVAQTR-UHFFFAOYSA-N3C4X574VE5
Show more names
2-amino-1-(2,4-dimethylphenyl)ethan-1-ol
5-(1-Hydroxy-2-aminoethyl)salicylamide5-(1-hydroxy-2-aminoethyl)-salicylamideG827635-((1RS)-2-Amino-1-hydroxyethyl)-2-hydroxybenzamideLABETALOL HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Database identifiers
- CAS
68807-83-0- PubChem CID
- 15565663
- DTXSID
DTXSID80574370- UNII
- 3C4X574VE5
Properties
Computed structural propertiesFilling in
- XLogP
- -1.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Boiling point
- 448.5 · 448.5±45.0 °C(Predicted)
- Density
- 1.388 · 1.388±0.06 g/cm3(Predicted)
- pka
- 8.1 · 8.10±0.31(Predicted)
Chemistry & industry
Suppliers13 total
北京科迈启医药科技有限公司15910349257 15910349257 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
广州九植医药科技有限公司020-89854820 · [email protected]
深圳市洛克医药科技有限公司13128912434 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
湖北瑞诺医药科技有限公司13165688766 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
江西叶宏医药科技有限公司0793-15967982-804 13970348580 · [email protected]
广州市震霖医药科技有限公司020-18102736 13622807357 · [email protected]
Related reactions
8 records
Compound notes
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