Basic information
- CAS
447429-09-6- Standard SMILES
Nc1ccc2c(c1)OC1(CCCC1)O2- InChIKey
BZDIQBHWAGKIDI-UHFFFAOYSA-N- Molecular formula
- C11H13NO2
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.09462866
Names & identifiers
- Preferred name
- Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine
- IUPAC
- spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amine
- English name
- Spiro[1,3-benzodioxole-2,1-cyclopentan]-5-amine (9CI)
- Molecular formula
- C11H13NO2
- Molecular weight
- 191.23
Names & synonyms
447429-09-6spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amineSpiro(benzo[1,3]dioxole-2,1'-cyclopentan)-5-ylamineSpiro[benzo[d][1,3]dioxole-2,1'-cyclopentan]-5-aminespiro[1,3-benzodioxole-2,1'-cyclopentan]-5-aminespiro[1,3-dioxaindane-2,1'-cyclopentane]-6-amineSpiro[1,3-benzodioxole-2,1//'-cyclopentane]-5-aminespiro[benzo[d]1,3-dioxolene-2,1'-cyclopentane]-5-ylamineMLS-0268308.0001MFCD02933267Oprea1_084330SCHEMBL1749235
Show more names
spiro[1,3-benzodioxole-2,1'-cyclopentane]-6-amine
CHEMBL1624555BDBM46040cid_2927039DTXSID00352359Spiro[1,3-benzodioxole-2,1-cyclopentan]-5-amine (9CI)XSA42909SBB002589STK734285
Database identifiers
- CAS
447429-09-6- PubChem CID
- 723950
- DTXSID
DTXSID00352359- ChEMBL
CHEMBL1624555
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 225
Chemistry & industry
Suppliers5 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海智乾生物科技有限公司[email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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