Basic information
- CAS
182-55-8- Standard SMILES
c1ccc2c(c1)OC1(CCCCC1)O2- InChIKey
SPXULWFZNXFRHI-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- Spiro(1,3-benzodioxole-2,1'-cyclohexane)
- IUPAC
- spiro[1,3-benzodioxole-2,1'-cyclohexane]
- English name
- spiro[1,3-benzodioxole-2,1'-cyclohexane]
- Molecular formula
- C12H14O2
- Molecular weight
- 190.24
Names & synonyms
Spiro[1,3-benzodioxole-2,1'-cyclohexane]182-55-8Spiro(1,3-benzodioxole-2,1'-cyclohexane)EINECS 205-873-3NSC 25097AI3-06452DTXSID5059749RefChem:184763DTXCID1035787205-873-3SPXULWFZNXFRHI-UHFFFAOYSA-NN979VA5PEP
Show more names
Spiro[1,3-benzodioxole-2,1'-cyclohexane
NSC-25097Spiro[1,3-benzodioxole-2,1/'-cyclohexane]NSC25097Spiro[1,1'-cyclohexane]UNII-N979VA5PEPSCHEMBL368479CHEMBL5287088SCHEMBL31426431
Database identifiers
- CAS
182-55-8- PubChem CID
- 67440
- DTXSID
DTXSID5059749- ChEMBL
CHEMBL5287088- UNII
- N979VA5PEP
- EC Number
- 205-873-3
- Nikkaji
- J193.668I
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- FDA UNII
- 979 VA5PEP · N979VA5PEP
- EPA Substance Registry System
- 1 · Spiro[1,3-benzodioxole-2,1'-cyclohexane] (182-55-8)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationSpiro[1,3-benzodioxole-2,1'-cyclohexane]: INACTIVE
Upstream & downstream products
Downstream products
Suppliers5 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…