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N-Methyl-3-(phenylthio)-1-propanamine

N-Methyl-3-(phenylthio)-1-propanamine structure

CAS No:
114458-67-2
Formula:
C10H15NS
Chemical Name:
N-Methyl-3-(phenylthio)-1-propanamine
Synonyms:
1-Propanamine,N-methyl-3-(phenylthio)-;N-Methyl-3-(phenylthio)-1-propanamine

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N-Methyl-3-(phenylthio)-1-propanamine Basic Attributes

Molecular Weight：

181.29800

Exact Mass：

181.30

DSSTox ID：

DTXSID90472111

Characteristics

PSA：

37.33000

XLogP3：

2.77910

Density：

1.02g/cm3

Boiling Point：

85 °C @ Press: 0.3 Torr

Flash Point：

122.403ºC

Refractive Index：

1.554

Vapor Pressure：

0.004mmHg at 25°C

Computed Properties

Molecular Weight:181.30
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:181.09252066
Monoisotopic Mass:181.09252066
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:100
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-Methyl-3-(phenylthio)-1-propanamine

Basic Attributes
Characteristics
Computed Properties

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