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N-(3-Isothiocyanatophenyl)acetamide

N-(3-Isothiocyanatophenyl)acetamide structure

CAS No:
3137-83-5
Formula:
C9H8N2OS
Chemical Name:
N-(3-Isothiocyanatophenyl)acetamide
Synonyms:
Acetamide,N-(3-isothiocyanatophenyl)-;Isothiocyanic acid,m-acetamidophenyl ester;N-(3-Isothiocyanatophenyl)acetamide;3-Acetamidophenyl isothiocyanate

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N-(3-Isothiocyanatophenyl)acetamide Basic Attributes

Molecular Weight：

192.23800

Exact Mass：

192.24

EC Number：

221-536-3

DSSTox ID：

DTXSID8062860

HScode：

2930909090

Characteristics

PSA：

73.55000

XLogP3：

2.45230

Density：

1.17g/cm3

Melting Point：

156-157 °C

Boiling Point：

417ºC at 760mmHg

Flash Point：

206ºC

Refractive Index：

1.595

Water Solubility：

56.71mg/L(25 ºC)

N-(3-Isothiocyanatophenyl)acetamide Use and Manufacturing

Manufacturing Info：

Acetamide, N-(3-isothiocyanatophenyl)-: ACTIVE

Computed Properties

Molecular Weight:192.24
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:192.03573406
Monoisotopic Mass:192.03573406
Topological Polar Surface Area:73.6
Heavy Atom Count:13
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(3-Isothiocyanatophenyl)acetamide

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

N-(3-Isothiocyanatophenyl)acetamide

SDS

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