Basic information
- CAS
81861-30-5- Standard SMILES
COc1ccc2c(c1)CCC(N)C2- InChIKey
WASIYUSITZITPW-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 6-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylamine
- IUPAC
- 6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
- English name
- 6-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylamine
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
81861-30-56-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine6-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylamine6-methoxytetralin-2-amineMFCD041149152-NAPHTHALENAMINE, 1,2,3,4-TETRAHYDRO-6-METHOXY-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-ylamineCHEMBL992152-amino-6-methoxytetralinSCHEMBL264631DTXSID90274652WASIYUSITZITPW-UHFFFAOYSA-N
Show more names
Rotigotine Impurity 586-Methoxy-1,2,3,4-tetrahydro-2-naphthalenamine6-Methoxy-1,2,3,4-tetrahydro-phthalen-2-ylamine(R)-2-amino-1-(4-(trifluoromethyl)phenyl)ethan-1-ol
BDBM50020512FD7335AKOS015901734AB19245FM51661AS-49313PD033606SY274030
Database identifiers
- CAS
81861-30-5- PubChem CID
- 19907
- DTXSID
DTXSID90274652- ChEMBL
CHEMBL99215
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
Physicochemical properties
- Boiling point
- 299.6 · 299.6±40.0 °C(Predicted)
- Density
- 1.056 · 1.056±0.06 g/cm3(Predicted)
- pka
- 10.1 · 10.10±0.20(Predicted)
Chemistry & industry
Suppliers15 total
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海皓骏医药科技有限公司021-34621078 13120882795 · [email protected]
上海威芬奇医药科技有限公司13817485796 · [email protected]
上海波以尔化工有限公司021-50182298 021-50180596 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
上海智乾生物科技有限公司[email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
16 records
Compound notes
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