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Basic information
- CAS
3583-05-9- Standard SMILES
CC(N)Cc1ccc(O)c(O)c1- InChIKey
KSRGADMGIRTXAF-UHFFFAOYSA-N- Molecular formula
- C9H13NO2
- Average molar mass
- 167.2 g/mol
- Monoisotopic mass
- 167.09462866
Names & identifiers
- Preferred name
- (+-)-alpha-Methyldopamine
- IUPAC
- 4-(2-aminopropyl)benzene-1,2-diol
- English name
- alpha-methyldopamine
- Molecular formula
- C9H13NO2
- Molecular weight
- 167.21
Names & synonyms
alpha-Methyldopamine3,4-Dihydroxyamphetamine555-64-6CatecholamphetamineXQ9A7WCY2LDTXSID008972354-(2-Aminopropyl)-1,2-benzenediol1,2-Benzenediol, 4-(2-aminopropyl)-RefChem:905504(+-)-alpha-MethyldopamineDTXCID708427974-(2-aminopropyl)benzene-1,2-diol
Show more names
a-MethyldopamineBRN 2088428dl-alpha-MethyldopamineUNII-XQ9A7WCY2LKSRGADMGIRTXAF-UHFFFAOYSA-N1-13-00-00327 (Beilstein Handbook Reference)(+-)-4-(2-Aminopropyl)-1,2-benzenediolPyrocatechol, 4-(2-aminopropyl)-, (+-)-
Database identifiers
- CAS
3583-05-9、555-64-6- PubChem CID
- 17005
- DTXSID
DTXSID00897235- ChEMBL
CHEMBL28278- ChEBI
CHEBI:193722- UNII
- XQ9A7WCY2L
- Nikkaji
- J354.283A
Properties
Computed structural propertiesFilling in
- XLogP
- -0.5
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- FDA UNII
- 9 A7WCY2L · XQ9A7WCY2L
Chemistry & industry
Suppliers2 total
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Additional notes
DefinitionChEBI: A-Methyldopamine is a member of amphetamines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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