2-Amino-4'-methoxyacetophenone

HCID 412889CAS 40513-43-7

Basic information

Standard SMILES
COc1ccc(C(=O)CN)cc1
InChIKey
CNYAWQABGNEMFC-UHFFFAOYSA-N
Molecular formula
C9H11NO2
Average molar mass
165.19 g/mol
Monoisotopic mass
165.07897859

Names & identifiers

Preferred name
2-Amino-4'-methoxyacetophenone
IUPAC
2-amino-1-(4-methoxyphenyl)ethanone
English name
2-Amino-4'-methoxyacetophenone
Molecular formula
C9H11NO2
Molecular weight
165.19

Names & synonyms

2-Amino-4'-methoxyacetophenone40513-43-7DTXSID90328649RefChem:255415DTXCID602797552-amino-1-(4-methoxyphenyl)ethanone2-amino-1-(4-methoxyphenyl)ethan-1-oneEthanone, 2-amino-1-(4-methoxyphenyl)-, hydrochlorideF0081-0099MFCD002095432-Amino-4 inverted exclamation mark -methoxyacetophenoneEthanone,2-amino-1-(4-methoxyphenyl)-
Show more names
4-(Aminoacetyl)anisolea-Amino-4methoxyacetophenone2-Amino-4'-mthoxyacetophenoneα-Amino-4’-methoxyacetophenone2-AMINO-4-METHOXYACETOPHENONE, 98+%Ethanone, 2-amino-1-(4-methoxyphenyl)-a-Amino-4-methoxyacetophenone hydrochlorideα-Amino-4’-methoxyacetophenone hydrochloride
SCHEMBL182867alpha-amino-p-methoxyacetophenone2-Amino-4'-methoxy acetophenoneCNYAWQABGNEMFC-UHFFFAOYSA-NSMSSF-0612955ALBB-028499SBB064222STL353644

Database identifiers

CAS
40513-43-7
PubChem CID
412889
DTXSID
DTXSID90328649
Nikkaji
J329.138C

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
52.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
12

Physicochemical properties

Melting point
168 °C · 168 °C
Boiling point
315.4 · 315.4±22.0 °C(Predicted)
Density
1.111 · 1.111±0.06 g/cm3(Predicted)
pka
7.17 · 7.17±0.29(Predicted)
CAS DataBase Reference
40513 · 40513-43-7(CAS DataBase Reference)

Chemistry & industry

Suppliers31 total

宁波振岳医药科技有限公司19817745290 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]

Related reactions

10 records

Linked notes

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