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5,6-Dimethoxy-1,2,3,4-tetrahydronaphthalen-2-amine

HCID 30657
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
21489-50-9
Standard SMILES
COc1ccc2c(c1OC)CCC(N)C2
InChIKey
BDHOUGWYKHSPIX-UHFFFAOYSA-N
Molecular formula
C12H17NO2
Average molar mass
207.27 g/mol
Monoisotopic mass
207.12592878

Names & identifiers

Preferred name
5,6-Dimethoxy-1,2,3,4-tetrahydronaphthalen-2-amine
IUPAC
5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-amine
English name
1,2,3,4-Tetrahydro-5,6-dimethoxy-2-naphthalenamine
Molecular formula
C12H17NO2
Molecular weight
207.27

Names & synonyms

21489-50-95,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-amineDTXSID10944082RefChem:1072203DTXCID709684411,2,3,4-Tetrahydro-5,6-dimethoxy-2-naphthylaminebeta-Naphthylamine, 5,6-dimethoxy-1,2,3,4-tetrahydro-5,6-Dimethoxy-1,2,3,4-tetrahydro-beta-naphthylamineSCHEMBL65468425,6-dimethoxy-2-amino-tetralinBDHOUGWYKHSPIX-UHFFFAOYSA-N2-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-5,6-DIMETHOXY-
Show more names
2-Naphthylamine,1,2,3,4-tetrahydro-5,6-dimethoxy-1,2,3,4-Tetrahydro-5,6-dimethoxy-2-naphthalenamine2-Naphthalenamine, 1,2,3,4-tetrahydro-5,6-dimethoxy-
PD0336111,2,3,4-tetrahydro-5,6-dimethoxy-2- aminonaphthalene

Database identifiers

CAS
21489-50-9
PubChem CID
30657
DTXSID
DTXSID10944082
Nikkaji

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
44.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
210

Chemistry & industry

Suppliers1 total

德拜科技有限公司00852-2521 1836

Related reactions

2 records
New reaction record
HRID 2050567 reaction equation
HRID 2050567As reactantuspto-grants-1991_05
HRID 2157882 reaction equation
HRID 2157882As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
J42.467F