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(S)-(-)-1-PHENYLPROPYLISOTHIOCYANATE

(S)-(-)-1-PHENYLPROPYLISOTHIOCYANATE structure

CAS No:
737001-04-6
Formula:
C10H11NS
Chemical Name:
(S)-(-)-1-PHENYLPROPYLISOTHIOCYANATE
Synonyms:
(S)-(-)-1-PHENYLPROPYL ISOTHIOCYANATE;[(1S)-1-isothiocyanatopropyl]benzene;Benzene, [(1S)-1-isothiocyanatopropyl]-

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(S)-(-)-1-PHENYLPROPYLISOTHIOCYANATE Basic Attributes

Molecular Weight：

177.27

Exact Mass：

177.06122053

DSSTox ID：

DTXSID20426965

Characteristics

Density：

1,054 g/cm3

Boiling Point：

128-129°C 9mm

Refractive Index：

1.5717

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2810

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Computed Properties

Molecular Weight:177.27
XLogP3:4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:177.06122053
Monoisotopic Mass:177.06122053
Topological Polar Surface Area:44.4
Heavy Atom Count:12
Complexity:167
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (S)-(-)-1-PHENYLPROPYLISOTHIOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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