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(2S)-1-(1,3-benzodioxol-5-yl)propan-2-ol

(2S)-1-(1,3-benzodioxol-5-yl)propan-2-ol structure

CAS No:
172542-26-6
Formula:
C10H12O3
Chemical Name:
(2S)-1-(1,3-benzodioxol-5-yl)propan-2-ol
Synonyms:
S-3,4-Methylene-dioxyphenylisopropanol;

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(2S)-1-(1,3-benzodioxol-5-yl)propan-2-ol Basic Attributes

Molecular Weight：

180.20000

Exact Mass：

180.078644241

Characteristics

PSA：

38.69000

XLogP3：

1.33860

Density：

1.219g/cm3

Boiling Point：

292.1ºC at 760mmHg

Flash Point：

130.5ºC

Refractive Index：

1.564

Vapor Pressure：

0.001mmHg at 25°C

Computed Properties

Molecular Weight:180.20
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:180.078644241
Monoisotopic Mass:180.078644241
Topological Polar Surface Area:38.7
Heavy Atom Count:13
Complexity:172
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S)-1-(1,3-benzodioxol-5-yl)propan-2-ol

Basic Attributes
Characteristics
Computed Properties

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