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4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL structure

CAS No:
322412-27-1
Formula:
C12H13N3S
Chemical Name:
4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
Synonyms:
TIMTEC-BB SBB009840;CHEMBRDG-BB 3003321;4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL;AKOS BBS-00003309;Albb-003266;4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol(SALTDATA: FREE);4-Allyl-5-m-tolyl-4H-1,2,4-triazole-3-thiol;4-allyl-5-(3-methylphenyl)-2H-1,2,4-triazole-3-thione

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4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL Basic Attributes

Molecular Weight：

231.32

Exact Mass：

231.08300

DSSTox ID：

DTXSID20354234

Characteristics

PSA：

59.7

XLogP3：

2.72820

Density：

1.18g/cm3

Boiling Point：

327.6ºC at 760 mmHg

Flash Point：

151.9ºC

Refractive Index：

1.63

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:231.32
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:231.08301860
Monoisotopic Mass:231.08301860
Topological Polar Surface Area:59.7
Heavy Atom Count:16
Complexity:324
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-ALLYL-5-(3-METHYLPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

SDS

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