Molecular properties
- Formula
- C5H10O2
- Molar mass
- 102.13 g·mol−1
- Exact mass
- 102.0681 Da
- 1
- 0
- 2
- 26.30 Ų
- 1.1 (PubChem computed XLogP3-AA descriptor)
- CAS
- 762-75-4
- PubChem CID
- 61207
Molecule record
TERT-BUTYL FORMATE
C5H10O2
102.13 g/mol
Interactions
- Polarity
- Often weakly polar or nonpolar unless other structural features dominate.
- Acid-base behavior
- Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
- Intermolecular forces
- Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.
Functional groups
No functional-group assignment has been curated yet.
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 1.1 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1,1-dimethylethyl formate
- 212-105-0
- 762-75-4
- Butyl formate, tert-
- DTXCID304690
- DTXSID4024690
- EINECS 212-105-0
- Formate, t-butyl-
Show all 21 synonyms
- Formic acid, 1,1-dimethylethyl ester
- Formic acid, tert-butyl ester
- Formic acid-tert-butyl ester
- H-Boc
- H-t-Boc
- J5BC8DA85J
- MFCD00003290
- RefChem:894660
- TERT-BUTYLOXYCARBONYL GROUP
- t-Butyl formate
- tert-Butyl formate, 99%
- tertiary butyl formate
- tet.-Butyl formate
Structure identifiers
- Canonical SMILES
- CC(C)(C)OC=O
- Isomeric SMILES
- CC(C)(C)OC=O
- InChI
- InChI=1S/C5H10O2/c1-5(2,3)7-4-6/h4H,1-3H3
- InChIKey
- RUPAXCPQAAOIPB-UHFFFAOYSA-N
- PubChem CID
- 61207
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for TERT-BUTYL FORMATE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for TERT-BUTYL FORMATE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.