cis-4-((t-Butyldimethylsilyl)oxy)cyclohexan-1-ol

HCID 554539

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 103202-62-6
Standard SMILES: CC(C)(C)[Si](C)(C)OC1CCC(O)CC1
InChIKey: XGCCUZRKNCUVJK-UHFFFAOYSA-N
Molecular formula: C12H26O2Si
Average molar mass: 230.42 g/mol
Monoisotopic mass: 230.1702066

Names & identifiers

Preferred name: cis-4-((t-Butyldimethylsilyl)oxy)cyclohexan-1-ol
IUPAC: 4-[tert-butyl(dimethyl)silyl]oxycyclohexan-1-ol
English name: cis-4-tert-Butyldimethylsilyloxycyclohexanol
Molecular formula: C12H26O2Si
Molecular weight: 230.42

Names & synonyms

103202-62-6trans-4-[t-Butyl(dimethyl)silyl]oxycyclohexanolcis-4-[(t-Butyldimethylsilyl)oxy]cyclohexan-1-oltrans-4-(t-Butyl(dimethyl)silyl)oxycyclohexanolcis-4-((t-Butyldimethylsilyl)oxy)cyclohexan-1-olRefChem:577342894-587-8974-134-1126931-29-14-((tert-Butyldimethylsilyl)oxy)cyclohexanol103202-63-7trans-4-[tert-butyl(dimethyl)silyl]oxycyclohexanol

Show more names

(1s,4s)-4-((tert-butyldimethylsilyl)oxy)cyclohexan-1-olcis-4-tert-Butyldimethylsilyloxycyclohexanol4-(TERT-BUTYLDIMETHYLSILYLOXY)-1-CYCLOHEXANOLcis-(1s,4s)-4-((Tert-butyldimethylsilyl)oxy)cyclohexan-1-olCyclohexanol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, cis-

Cyclohexanol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-cis-4-((tert-Butyldimethylsilyl)oxy)cyclohexan-1-ol4-[tert-butyl(dimethyl)silyl]oxycyclohexan-1-olMFCD13190776MFCD29052535MFCD308029894-(tert-Butyl-dimethyl-silanyloxy)-cyclohexanolcis-4-[(tert-butyldimethylsilyl)oxy]cyclohexan-1-ol

Database identifiers

CAS: 103202-62-6、103202-63-7、126931-29-1
PubChem CID: 554539
DTXSID: DTXSID90339210
EC Number: 894-587-8、974-134-1
Nikkaji: J2.754.006F

Properties

Computed structural properties

Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 200

Physicochemical properties

Melting point: 47.6 · 47.6-49.4 °C
Boiling point: 265.7 · 265.7±33.0 °C(Predicted)
Density: 0.92 · 0.92±0.1 g/cm3(Predicted)
storage temp.: 0 · Store at 0-8 °C
pka: 14.98 · 14.98±0.40(Predicted)
Appearance: white solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, 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.

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501