N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine

HCID 3673869

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Basic information

CAS: 887352-04-7
Standard SMILES: COc1ccc(CCN(C)C(=O)CC(C)=O)cc1OC
InChIKey: PJZKMELWTFQEPH-UHFFFAOYSA-N
Molecular formula: C15H21NO4
Average molar mass: 279.33 g/mol
Monoisotopic mass: 279.14705815

Names & identifiers

Preferred name: N-Acetoacetyl-N-methyl-2-(3,4-dimethoxyphenyl)ethylamine
IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxobutanamide
English name: N-ACETOACETYL-N-METHYL-2-(3,4-DIMETHOXYPHENYL)ETHYLAMINE
Molecular formula: C15H21NO4
Molecular weight: 279.33

Names & synonyms

887352-04-7N-ACETOACETYL-N-METHYL-2-(3,4-DIMETHOXYPHENYL)ETHYLAMINEN-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxobutanamideN-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxo-butanamideDTXSID30394904MFCD03701111AKOS030254285AB15730DB-320858N-(3,4-dimethoxyphenethyl)-N-methyl-3-oxobutanamideButanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxo-

Database identifiers

CAS: 887352-04-7
PubChem CID: 3673869
DTXSID: DTXSID30394904

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 55.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 7
Heavy atoms: 20
Formal charge: 0
Complexity: 332

Physicochemical properties

storage temp.: Refrigerator
solubility: Acetone, Ether, Ethyl Acetate
form: Syrup
color: Red
CAS DataBase Reference: 887352 · 887352-04-7

Chemistry & industry

Suppliers4 total

武汉易泰科技有限公司上海分公司18930552037 · [email protected]

凯试（上海）科技有限公司021-50135380 · [email protected]

深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]

北京百灵威科技有限公司18210857532 18210857532 · [email protected]

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Compound notes

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