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2-bromo-1-isothiocyanato-4-propan-2-ylbenzene

2-bromo-1-isothiocyanato-4-propan-2-ylbenzene structure

CAS No:
246166-33-6
Formula:
C10H10BrNS
Chemical Name:
2-bromo-1-isothiocyanato-4-propan-2-ylbenzene
Synonyms:
OR0137; 2-Bromo-4-isopropylphenyl isothiocyanate;

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2-bromo-1-isothiocyanato-4-propan-2-ylbenzene Basic Attributes

Molecular Weight：

256.16200

Exact Mass：

254.97173

DSSTox ID：

DTXSID70370808

HScode：

2930909090

Characteristics

PSA：

44.45000

XLogP3：

4.30680

Density：

1.35g/cm3

Boiling Point：

321.1ºC at 760mmHg

Flash Point：

148ºC

Refractive Index：

1.587

Vapor Pressure：

0.000572mmHg at 25°C

Safety Information

Marks：

Computed Properties

Molecular Weight:256.16
XLogP3:5.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:254.97173
Monoisotopic Mass:254.97173
Topological Polar Surface Area:44.4
Heavy Atom Count:13
Complexity:211
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-bromo-1-isothiocyanato-4-propan-2-ylbenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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