Basic information
- CAS
34868-49-0- Standard SMILES
Cc1cc(C)c(C2(C)OC[C@@H](COC(N)=O)O2)c(C)c1- InChIKey
SWCNFUWOEPLJIN-KEKZHRQWSA-N- Molecular formula
- C15H21NO4
- Average molar mass
- 279.33 g/mol
- Monoisotopic mass
- 279.14705815
Names & identifiers
- Preferred name
- 1,3-Dioxolane-4-methanol, 2-p-cumenyl-2-methyl-, carbamate, trans-
- IUPAC
- [(4S)-2-methyl-2-(2,4,6-trimethylphenyl)-1,3-dioxolan-4-yl]methyl carbamate
Names & synonyms
trans-2-p-Cumenyl-2-methyl-1,3-dioxolane-4-methanol carbamatetrans-2-Methyl-2-(p-isopropylphenyl)-4-carbamoyloxymethyl-1,3-dioxolane1,3-DIOXOLANE-4-METHANOL, 2-p-CUMENYL-2-METHYL-, CARBAMATE, trans-34868-49-0RefChem:219005DTXSID20956353[(4S)-2-Methyl-2-(2,4,6-trimethylphenyl)-1,3-dioxolan-4-yl]methyl hydrogen carbonimidate[2-Methyl-2-(2,4,6-trimethylphenyl)-1,3-dioxolan-4-yl]methyl hydrogen carbonimidate
Database identifiers
- CAS
34868-49-0- PubChem CID
- 36977
- DTXSID
DTXSID20956353
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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