Basic information
- CAS
88493-58-7- Standard SMILES
CN1CCc2ccc(O)cc2C1- InChIKey
ZGSNCXKJBYAIOL-UHFFFAOYSA-N- Molecular formula
- C10H13NO
- Average molar mass
- 163.22 g/mol
- Monoisotopic mass
- 163.09971404
Names & identifiers
- Preferred name
- 2-Methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
- IUPAC
- 2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
- English name
- 1,2,3,4-tetrahydro-2-Methylisoquinolin-7-ol
- Molecular formula
- C10H13NO
- Molecular weight
- 163.22
Names & synonyms
2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol88493-58-71,2,3,4-tetrahydro-2-methylisoquinolin-7-ol2-methyl-3,4-dihydro-1H-isoquinolin-7-olNSC142682SCHEMBL4323033SCHEMBL29598312DTXSID50301377AKOS004902098AB89737NSC-142682DA-30422
Show more names
1,2,3,4-tetrahydro-2-methyl-7-isoquinolinol7-Isoquinolinol, 1,2,3,4-tetrahydro-2-methyl-
Database identifiers
- CAS
88493-58-7- PubChem CID
- 285644
- DTXSID
DTXSID50301377
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 171 °C · 171 °C
- Boiling point
- 286.9 · 286.9±40.0 °C(Predicted)
- Density
- 1.119 · 1.119±0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- pka
- 10.22 · 10.22±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Applications
Uses2-Methyl-1,2,3,4-tetrahydroisoquinolin-7-ol is used in the synthesis of Lamitidine-analogs derivatives of N-(3-Hydroxyphenyl)guanidine and 5- and 7-Hydroxytetrahydroisoquinolone which displays anti-histaminic-H2 activity.Also, it is an intermediate used in the synthesis of 1,2,3,4-Tetrahydro-4-(1-hydroxycyclohexyl)-2-methyl-7-isoquinolinol (T293623), which is a useful synthetic compound.
Suppliers1 total
上海景容化学科技有限公司021-60546673 13701861782 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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