alpha-Terpinyl pyrophosphate
Basic information
- CAS
143563-42-2- Standard SMILES
CC1=CCC(C(C)(C)OP(=O)(O)OP(=O)(O)O)CC1- InChIKey
VPIGSRIRALQQKD-UHFFFAOYSA-N- Molecular formula
- C10H20O7P2
- Average molar mass
- 314.21 g/mol
- Monoisotopic mass
- 314.06842697
Overview
structure given in first source
Names & identifiers
- Preferred name
- alpha-Terpinyl pyrophosphate
- IUPAC
- 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl phosphono hydrogen phosphate
- English name
- alpha-terpinyl pyrophosphate
- Molecular formula
- C10H20O7P2
- Molecular weight
- 314.209122
Names & synonyms
alpha-Terpinyl pyrophosphateATOPP143563-42-2RefChem:111394DTXSID909319502-(4-Methylcyclohex-3-en-1-yl)propan-2-yl trihydrogen diphosphate
Database identifiers
- CAS
143563-42-2- PubChem CID
- 197489
- DTXSID
DTXSID90931950
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 451
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…