(2R)-3-(tert-butoxy)-2-methylpropan-1-ol

HCID 12536780

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Basic information

CAS: 59982-04-6
Standard SMILES: C[C@H](CO)COC(C)(C)C
InChIKey: AARKSKPTFDLLAS-SSDOTTSWSA-N
Molecular formula: C8H18O2
Average molar mass: 146.23 g/mol

Names & identifiers

Preferred name: (2R)-3-(tert-butoxy)-2-methylpropan-1-ol
IUPAC: (2R)-2-methyl-3-[(2-methylpropan-2-yl)oxy]propan-1-ol

Names & synonyms

(2R)-3-(tert-butoxy)-2-methylpropan-1-ol59982-04-6SCHEMBL4181748AARKSKPTFDLLAS-SSDOTTSWSA-N(R)-3-t-butoxy-2-methyl-1-propanol(R)-3-(tert-Butoxy)-2-methylpropan-1-ol(R)-(+)-3-tert. butoxy-2-methyl-1-propanolEN300-24497653

Database identifiers

CAS: 59982-04-6
PubChem CID: 12536780
EC Number: 173-084-0

Properties

Computed structural propertiesFilling in

XLogP: 1.2
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 10
Formal charge: 0
Complexity: 83.7

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.