6,7-Dimethoxy-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
Basic information
- CAS
188553-89-1- Standard SMILES
COc1cccc(C2NCCc3cc(OC)c(OC)cc32)c1- InChIKey
YXWSSJFORTVBKI-UHFFFAOYSA-N- Molecular formula
- C18H21NO3
- Average molar mass
- 299.4 g/mol
- Monoisotopic mass
- 299.15214353
Names & identifiers
- Preferred name
- 6,7-Dimethoxy-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
- IUPAC
- 6,7-dimethoxy-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
Names & synonyms
6,7-dimethoxy-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline188553-89-1DTXSID00385208RefChem:306186DTXCID60336231Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-(3-methoxyphenyl)-Oprea1_298339Oprea1_762136HMS5090M02HTS20455NSC763859STK677525
Show more names
AKOS001755898AKOS022014607NSC-763859EU-0019330UNM000011057901AG-690/37046030SR-01000534006SR-01000534006-1
Database identifiers
- CAS
188553-89-1- PubChem CID
- 2828702
- DTXSID
DTXSID00385208
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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