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(4R,5R)-2,2-Dimethyl-5-vinyl-1,3-dioxolane-4-carbaldehyde

HCID 178763989
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Basic information

CAS
155934-55-7
Standard SMILES
C=C[C@H]1OC(C)(C)O[C@H]1C=O
InChIKey
AMXAGLAPRRVGDY-RQJHMYQMSA-N
Molecular formula
C8H12O3
Average molar mass
156.18 g/mol

Names & identifiers

Preferred name
(4R,5R)-2,2-Dimethyl-5-vinyl-1,3-dioxolane-4-carbaldehyde
IUPAC
(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
English name
D-erythro-Pent-4-enose, 4,5-dideoxy-2,3-O-(1-methylethylidene)- (9CI)
Molecular formula
C8H12O3
Molecular weight
156.18

Names & synonyms

155934-55-7(4R,5R)-2,2-Dimethyl-5-vinyl-1,3-dioxolane-4-carbaldehyde(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carbaldehydeD-erythro-Pent-4-enose, 4,5-dideoxy-2,3-O-(1-methylethylidene)- (9CI)Ticagrelor Impurity 277SCHEMBL14709163CS-0165788EN300-1670603(4R,5R)-2,2-dimethyl-5-vinyl-1,3-dioxolane-4-carbaldehyde? (Ticagrelor Impurity pound(c)Ticagrelor Impurity 128Ticagrelor Impurity 314(4R,5R)-2,2-dimethyl-5-vinyl-[1,3]dioxolane-4-carbaldehyde
Show more names
D-erythro-Pent-4-enose, 4,5-dideoxy-2,3-O-(1-methylethylidene)-

Database identifiers

CAS
155934-55-7
Nikkaji
J1.537.466G

Properties

Computed structural propertiesFilling in

XLogP
0.7
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
174

Physicochemical properties

Boiling point
212.8 · 212.8±40.0 °C(Predicted)
Density
1.142 · 1.142±0.06 g/cm3(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

(3aR,4S,6R,6aS)-6-Aminotetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-ol4,7-Methano-4H-1,3-dioxolo[4,5-d][1,2]oxazine, tetrahydro-2,2-dimethyl-6-(phenylmethyl)-, (3aS,4S,7R,7aS)-

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