Basic information
- CAS
72828-32-1- Standard SMILES
C=C1CCC2CC1C2(C)C.CC1=CCC(C(C)(C)O)CC1.CC1=CCC2CC1C2(C)C.[Au+3].[Cl-].[Cl-].[Cl-]- InChIKey
GPUSAZILRWUOEM-UHFFFAOYSA-K- Molecular formula
- C30H50AuCl3O
- Average molar mass
- 730 g/mol
- Monoisotopic mass
- 728.259294
Names & identifiers
- Preferred name
- 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, mixed with alpha-pinene and beta-pinene, sulfurized, reaction products with gold chloride (AuCl3)
- IUPAC
- 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;gold(3+);2-(4-methylcyclohex-3-en-1-yl)propan-2-ol;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;trichloride
- English name
- 3-Cyclohexene-1-methanol, α,α,4-trimethyl-, mixed with α-pinene and -pinene, sulfurized, reaction products with gold chloride (AuCl3)
- Molecular formula
- C30H50AuCl3O
- Molecular weight
- 730.05
Names & synonyms
RefChem:935923-Cyclohexene-1-methanol, α,α,4-trimethyl-, mixed with α-pinene and -pinene, sulfurized, reaction products with gold chloride (AuCl3)
Database identifiers
- CAS
72828-32-1- PubChem CID
- 175180
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 530
Experimental & physicochemical properties
UVCBUVCB -> EPA TSCA
Physicochemical properties
- EPA Substance Registry System
- 3 · 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, mixed with .alpha.-pinene and .beta.-pinene, sulfurized, reaction products with gold chloride (AuCl3) (72828-32-1)
- 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 Information3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, mixed with .alpha.-pinene and .beta.-pinene, sulfurized, reaction products with gold chloride (AuCl3): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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