1-Propanone, 3-amino-1-phenyl-

HCID 408565
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Basic information

CAS
2677-69-2
Standard SMILES
NCCC(=O)c1ccccc1
InChIKey
HGZXQCCQZLSOPP-UHFFFAOYSA-N
Molecular formula
C9H11NO
Average molar mass
149.19 g/mol
Monoisotopic mass
149.08406397

Names & identifiers

Preferred name
1-Propanone, 3-amino-1-phenyl-
IUPAC
3-amino-1-phenylpropan-1-one
English name
1-Phenyl-3-amino-1-propanone
Molecular formula
C9H11NO
Molecular weight
149.19

Names & synonyms

2677-69-21-Propanone, 3-amino-1-phenyl-RefChem:10569893-amino-1-phenylpropan-1-one3-amino-1-phenyl-propan-1-one3-amino-1-phenyl-1-propanone1-phenyl-3-amino-1-propanoness-AminopropiophenonFluoxetine Impurity 34SCHEMBL932124SCHEMBL1808054SCHEMBL6006380
Show more names
Aminopropiophenoneβ-AminopropiophenoneEtilefrine Impurity 16
SCHEMBL28043023SCHEMBL28268504HGZXQCCQZLSOPP-UHFFFAOYSA-NSBB086649AKOS005266752CS-0105553D76552EN300-795209

Database identifiers

CAS
2677-69-2
PubChem CID
408565
Nikkaji
J80.542D

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
43.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11

Physicochemical properties

Melting point
128 °C · 128 °C
Boiling point
158 · 158-160 °C(Press: 2 Torr)
Density
1.056 · 1.056±0.06 g/cm3(Predicted)
pka
8.75 · 8.75±0.10(Predicted)

Chemistry & industry

Suppliers1 total

Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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