Oxirane, (1-methylpropyl)-

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Basic information

CAS: 70639-23-5
Standard SMILES: CCC(C)C1CO1
InChIKey: OVFUAYYHQWUHCD-UHFFFAOYSA-N
Molecular formula: C6H12O
Average molar mass: 100.16 g/mol
Monoisotopic mass: 100.088815

Names & identifiers

Preferred name: Oxirane, (1-methylpropyl)-
IUPAC: 2-butan-2-yloxirane

Names & synonyms

Oxirane, (1-methylpropyl)-70639-23-5DTXSID30415885RefChem:367381DTXCID003667342-(butan-2-yl)oxirane(R)-2-[(S)-sec-Butyl]oxirane3-methyl-1-pentene oxideSCHEMBL516891,2-epoxy 3-methyl pentaneSCHEMBL8718802OVFUAYYHQWUHCD-UHFFFAOYSA-N

Show more names

MFCD00044974AKOS01206840270640-56-1SY325205EN300-1826306

Database identifiers

CAS: 70639-23-5
PubChem CID: 5324166
DTXSID: DTXSID30415885
Nikkaji: J1.846.574D

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 7
Formal charge: 0
Complexity: 61.2

Related reactions

4 records

New reaction record

HRID 1111892As reactantuspto-grants-1978_10

HRID 1391113As reactantuspto-grants-1979_02

HRID 2083327As reactantuspto-grants-1978_04

HRID 2397798As reactantuspto-grants-1977_05

Compound notes

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