1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
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1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
structure -
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CAS No:
124655-09-0
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Formula:
C13H24O5
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Chemical Name:
1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
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Synonyms:
D-erythro-Hexonic acid,2,4-dideoxy-3,5-O-(1-methylethylidene)-,1,1-dimethylethyl ester;1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate;2-[(4R,6S)-6-(Hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetic acid tert-butyl ester;(6S-Hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4R-yl)acetic acid tert-butyl ester;((4R,6S)-6-Hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4-yl)acetic acid tert-butyl ester;tert-Butyl 2-[(4R,6S)-6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl)acetate;tert-Butyl 2-[(4R,6S)-6-(hydroxymethyl)-2,2-dimethyl[1,3]dioxan-4-yl]acetate;tert-Butyl 2-[(4R,6S)-2,2-dimethyl-6-(hydroxymethyl)-1,3-dioxan-4-yl]acetate
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CAS No:
1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate Basic Attributes
260.33
260.33
432-960-5
DTXSID50431244
2932999099
Characteristics
65
1
Colorless to light yellow liquid
1.0±0.1 g/cm3
330.9°C at 760 mmHg
113.1±14.4 °C
1.442
0mmHg at 25°C
Safety Information
P264, P270, P301+P312, P330, P501
H302
|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 8 companies from 2 notifications to the ECHA C&L Inventory.|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:260.33
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:260.16237386
Monoisotopic Mass:260.16237386
Topological Polar Surface Area:65
Heavy Atom Count:18
Complexity:292
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,1-Dimethylethyl 2,4-dideoxy-3,5-O-(1-methylethylidene)-D-erythro-hexonate
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