1(2H)-Naphthalenone, 3,4-dihydro-2-((dimethylamino)methyl)-

HCID 23812

Basic information

CAS
7353-59-5
Standard SMILES
CN(C)CC1CCc2ccccc2C1=O
InChIKey
OMCOACHXKJOZMD-UHFFFAOYSA-N
Molecular formula
C13H17NO
Average molar mass
203.28 g/mol
Monoisotopic mass
203.13101416

Names & identifiers

Preferred name
1(2H)-Naphthalenone, 3,4-dihydro-2-((dimethylamino)methyl)-
IUPAC
2-[(dimethylamino)methyl]-3,4-dihydro-2H-naphthalen-1-one
English name
2-[(Dimethylamino)methyl]tetralin-1-one
Molecular formula
C13H17NO
Molecular weight
203.28

Names & synonyms

2-Dimethylaminomethyltetralone7353-59-5N-538BRN 21060071-Dimethylaminomethyl-tetralon-21-Dimethylaminomethyl-tetralon-2 [German]1-Dimethylaminomethyl-3,4-dihydro-1(2H)-naphthalenone1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-2-((DIMETHYLAMINO)METHYL)-3-14-00-00192 (Beilstein Handbook Reference)RefChem:211496MFCD017125572-((Dimethylamino)methyl)-3,4-dihydronaphthalen-1(2H)-one
Show more names
3,4-Dihydro-2-(dimethylaminomethyl)-1(2H)-naphthalenone2-(Dimethylaminomethyl)-3,4-dihydronaphthalene-1(2H)-one1(2H)-Naphthalenone, 2-[(dimethylamino)methyl]-3,4-dihydro-2-[(dimethylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-one
2-[(dimethylamino)methyl]-3,4-dihydro-1(2H)-naphthalenone2-[(dimethylamino)methyl]-3,4-dihydronaphthalen-1(2H)-one2-[(DIMETHYLAMINO)METHYL]-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONENSC656287CHEMBL32454552-[(Dimethylamino)methyl]tetralin-1-one2-(dimethylaminomethyl)tetralin-1-oneSCHEMBL2125675

Database identifiers

CAS
7353-59-5
PubChem CID
23812
DTXSID
DTXSID10994305
ChEMBL
CHEMBL3245455、CHEMBL3302886
Nikkaji
J42.441B

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
15

Physicochemical properties

Boiling point
308 · 308.0±11.0 °C(Predicted)
Density
1.047 · 1.047±0.06 g/cm3(Predicted)
pka
8.81 · 8.81±0.28(Predicted)

Chemistry & industry

Suppliers3 total

济宁一泽医药科技有限公司15192473210 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
济南诺博汀精细化工有限公司18798187137 · [email protected]

Related reactions

4 records

Compound notes

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