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4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE

4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE structure

CAS No:
436151-85-8
Formula:
C10H7N3S
Chemical Name:
4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE
Synonyms:
BUTTPARK 41\03-40;4-(2-AMINO-1,3-THIAZOL-4-YL)BENZONITRILE;4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE;4-(4-CYANOPHENYL)-2-AMINOTHIAZOLE;AKOS BBR-001638;IFLAB-BB F1386-0385;4-(2-amino-4-thiazoyl)benzotrile;2-Amino-4-(4-cyanophenyl)-1,3-thiazole

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4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE Basic Attributes

Molecular Weight：

201.25

Exact Mass：

201.03600

DSSTox ID：

DTXSID20365926

HScode：

2934100090

Characteristics

PSA：

90.9

XLogP3：

2.84518

Density：

1.37 g/cm3

Boiling Point：

440.7ºC at 760 mmHg

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:201.25
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:201.03606841
Monoisotopic Mass:201.03606841
Topological Polar Surface Area:90.9
Heavy Atom Count:14
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-(2-AMINO-THIAZOL-4-YL)-BENZONITRILE

SDS

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