 Home > Encyclopedia > (1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

(1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

(1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol structure

CAS No:
133692-55-4
Formula:
C16H30O6
Chemical Name:
(1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol
Synonyms:
SEPRILOSE; UNII-5764EUK72N; Seprilose (USAN/INN);

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(1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol Basic Attributes

Molecular Weight：

318.40600

Exact Mass：

318.20423867 g/mol

UNII：

5764EUK72N

DSSTox ID：

DTXSID90158322

Characteristics

PSA：

77.38000

XLogP3：

1.57160

Density：

1.14g/cm3

Boiling Point：

436.3ºC

Flash Point：

217.7ºC

Refractive Index：

1.502

Vapor Pressure：

1.91E-09mmHg at 25°C

Computed Properties

Molecular Weight:318.41
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:318.20423867
Monoisotopic Mass:318.20423867
Topological Polar Surface Area:77.4
Heavy Atom Count:22
Complexity:335
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1R)-1-[(3aR,5R,6S,6aR)-6-heptoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

Basic Attributes
Characteristics
Computed Properties

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