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

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

CAS No:
92286-36-7
Formula:
C11H10ClN3S
Chemical Name:
4-ALLYL-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
Synonyms:
Albb-003246;ZERO/006571;MLS000108281;SMR000104242;ZINC00074280;ZINC01440216;A3218/0136521;A1918/0080604;CBMicro_038240;AG-205/12014162

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

Molecular Weight：

251.732

Exact Mass：

251.02800

DSSTox ID：

DTXSID00351322

HScode：

2933990090

Characteristics

PSA：

59.7

XLogP3：

3.07320

Density：

1.32g/cm3

Boiling Point：

339.6ºC at 760 mmHg

Flash Point：

159.2ºC

Refractive Index：

1.657

Computed Properties

Molecular Weight:251.74
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:251.0283962
Monoisotopic Mass:251.0283962
Topological Polar Surface Area:59.7
Heavy Atom Count:16
Complexity:329
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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

SDS

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