2-[4-(Dimethylamino)phenyl]-2-hydroxy-1-phenylethanone

HCID 590628CAS 33458-29-6
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)c1ccc(C(O)C(=O)c2ccccc2)cc1
InChIKey
DGPYFXUBTULRPD-UHFFFAOYSA-N
Molecular formula
C16H17NO2
Average molar mass
255.31 g/mol
Monoisotopic mass
255.12592879

Names & identifiers

Preferred name
2-[4-(Dimethylamino)phenyl]-2-hydroxy-1-phenylethanone
IUPAC
2-[4-(dimethylamino)phenyl]-2-hydroxy-1-phenylethanone
English name
2-[4-(Dimethylamino)phenyl]-2-hydroxy-1-phenylethan-1-one
Molecular formula
C16H17NO2
Molecular weight
255.31

Names & synonyms

33458-29-62-[4-(dimethylamino)phenyl]-2-hydroxy-1-phenylethan-1-one2-[4-(Dimethylamino)phenyl]-2-hydroxy-1-phenylethanone2-(4-dimethylaminophenyl)-2-hydroxy-1-phenylethanone2-(4-(dimethylamino)phenyl)-2-hydroxy-1-phenylethan-1-one4-(Dimethylamino)benzoin2-(4-(Dimethylamino)phenyl)-2-hydroxy-1-phenylethanone4'-dimethylaminobenzoinChemDiv3_000264Oprea1_567441Oprea1_622636SCHEMBL67860
Show more names
2-(4-(Dimethylamino)phenyl-2-hydroxy-1-phenylethanoneEthanone, 2-[4-(dimethylamino)phenyl]-2-hydroxy-1-phenyl-
CHEMBL192595DTXSID10343571HMS1473L22MFCD00837364AKOS022507280CCG-103586SS-4619IDI1_019582

Database identifiers

CAS
33458-29-6
PubChem CID
590628
DTXSID
DTXSID10343571
ChEMBL
CHEMBL192595
Nikkaji
J536.377B

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
40.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
19

Physicochemical properties

Melting point
163 · 163-164 °C
Boiling point
428.2 · 428.2±35.0 °C(Predicted)
Density
1.171 · 1.171±0.06 g/cm3(Predicted)
pka
12.8 · 12.80±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
2921420090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302+H312+H332
Precautionary statements
P260-P280-P312

Chemistry & industry

Suppliers4 total

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海恬枫生物科技有限公司18221172427; 18221172427 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]

Related reactions

5 records
New reaction record

Linked notes

Loading…