Chemical Properties of Atrolactic acid, TBDMS

Atrolactic acid, TBDMS

InChI
InChI=1S/C21H38O3Si2/c1-19(2,3)25(8,9)23-18(22)21(7,17-15-13-12-14-16-17)24-26(10,11)20(4,5)6/h12-16H,1-11H3
InChI Key
BWLSJNORQZZDTO-UHFFFAOYSA-N
Formula
C21H38O3Si2
SMILES
CC(O[Si](C)(C)C(C)(C)C)(C(=O)O[Si](C)(C)C(C)(C)C)c1ccccc1
Molecular Weight1
394.70
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Physical Properties

Property Value Unit Source
ω 0.6466 Relay (1.0) Calculated Property
ΔfG° -148.28 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -844.59 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 75.87 kJ/mol Relay (1.0) Calculated Property
IE 8.30 eV Relay (1.0) Calculated Property
log10WS -4.28 Relay (1.0) Calculated Property
logPoct/wat 6.472 Crippen Calculated Property
Pc 1221.30 kPa Relay (1.0-beta) Calculated Property
Inp 1970.00 NIST
Tboil 574.81 K Relay (1.0) Calculated Property
Tc 834.18 K Relay (1.0) Calculated Property
Tfus 328.98 K Relay (1.0) Calculated Property
Vc 1.300 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Propanoic acid, 2-hydroxy-2-phenyl, DTBS. 3-Hydroxymandelic acid, O,O-bis(tert-butyldimethylsilyl)-, tert-butyldimethylsilyl ester. N-Desmethyl-cis-tramadol, N-trimethylsilyl-, trimethylsilyl ether. 1«beta»-Acetoxyfuranoeudesm-3-ene. Mandelic acid di(tert-butyldimethylsilyl)-. Benzeneacetic acid, «alpha»,4-bis[(tert-butyldimethylsilyl)oxy]-3-methoxy-, tert-butyldimethylsilyl ester. 7,11b-Dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentol pentakis(trimethylsilyl) ether. Poligodial + p-Tyr (ethyl ester) adduct (S), acetylated, # 1. 6-Tetrahydrocannabinol, 7-hydroxy, allyl-DMS. trans-2,3-Tetralinediol, ferrocenylboronate. Poligodial + p-Tyr (ethyl ester) adduct (S). Poligodial + o-Tyr (ethyl ester) adduct (R,S). Poligodial + p-Tyr (ethyl ester) adduct (S), acetylated, # 2. 7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. Poligodial + Phe (methyl ester) adduct, (R).

Find more compounds similar to Atrolactic acid, TBDMS.

Sources

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