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Carbamic acid, N-[3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl ester

HCID 109404
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Basic information

CAS
68479-61-8
Standard SMILES
CCO[Si](CCCNC(=O)OC1CC(C)CCC1C(C)C)(OCC)OCC
InChIKey
RZTQENQVQRHAHZ-UHFFFAOYSA-N
Molecular formula
C20H41NO5Si
Average molar mass
403.6 g/mol
Monoisotopic mass
403.27539994

Names & identifiers

Preferred name
Carbamic acid, N-[3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl ester
IUPAC
(5-methyl-2-propan-2-ylcyclohexyl) N-(3-triethoxysilylpropyl)carbamate
English name
(S)-N-Triethoxysilylpropyl-O-menthocarbamate
Molecular formula
C20H41NO5Si
Molecular weight
403.63

Names & synonyms

Menthyl N-(3-triethoxysilylpropyl)carbamateEINECS 270-863-8Menthyl (3-(triethoxysilyl)propyl)carbamateDTXSID60887410Menthyl [3-(triethoxysilyl)propyl]carbamateCarbamic acid, (3-(triethoxysilyl)propyl)-, 5-methyl-2-(1-methylethyl)cyclohexyl esterCarbamic acid, N-(3-(triethoxysilyl)propyl)-, 5-methyl-2-(1-methylethyl)cyclohexyl esterCarbamic acid, [3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl esterCarbamic acid, N-[3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl esterRefChem:573997DTXCID10102670568479-61-8
Show more names
TriethoxysilylpropylOmenthocarbamate(S)-Nitrogen-triethoxysilylpropyl-oxy-menthylcarbamate5-methyl-2-(1-methylethyl)cyclohexyl [3-(triethoxysilyl)propyl]carbamate[3-(triethoxysilyl)propyl]-carbamicaci5-methyl-2-(1-methylethyl)cyclohexy[3-(Triethoxysilyl)propyl]carbamic acid 5-methyl-2-(1-methylethyl)cyclohexyl ester
(5-methyl-2-propan-2-ylcyclohexyl) N-(3-triethoxysilylpropyl)carbamate(S)-N-TRIETHOXYSILYLPROPYL-O-MENTHOCARBAMATEC20H41NO5SiSCHEMBL3117228(1S,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl N-[3-(triethoxysilyl)propyl]carbamate(S)-N-Triethoxysilylproply-O-menthocarbamateNS000616282-Isopropyl-5-methylcyclohexyl 3-(triethoxysilyl)propylcarbamate #

Properties

Computed structural properties

Topological polar surface area
66 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
13
Heavy atoms
27
Formal charge
0
Complexity
404

Physicochemical properties

Boiling point
444.009 · 444.009±24.00 °C(Press: 760.00 Torr)(predicted)
Density
0 · 0,985 g/cm3
refractive index
1.4526 · 1.4526
Flash point
110 °C · >110°C
pka
12.623 · 12.623±0.46(predicted)
Specific Gravity
0.985 · 0.985
Hydrolytic Sensitivity
7 · 7: reacts slowly with moisture/water
EPA Substance Registry System
3 · Menthyl [3-(triethoxysilyl)propyl]carbamate (68479-61-8)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationCarbamic acid, N-[3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexyl ester: ACTIVE

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Compound notes

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Database identifiers

CAS
68479-61-8
PubChem CID
109404
DTXSID
DTXSID60887410
EC Number
270-863-8
Nikkaji
J326.627C