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5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine structure

CAS No:
123217-00-5
Formula:
C11H13N3OS
Chemical Name:
5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine
Synonyms:
5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine;5-((2,3-DIMETHYLPHENOXY)METHYL)-1,3,4-THIADIAZOL-2-AMINE;SMR000146235;Oprea1_480300;Oprea1_704223;MLS000552720;CHEMBL1602474;CTK4B3428;ZINC52518;DTXSID70350665

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5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine Basic Attributes

Molecular Weight：

235.305

Exact Mass：

235.078

DSSTox ID：

DTXSID70350665

HScode：

2934999090

Characteristics

PSA：

89.3

XLogP3：

2.2

Density：

1.272g/cm3

Boiling Point：

433.8ºC at 760 mmHg

Flash Point：

216.1ºC

Refractive Index：

1.631

Vapor Pressure：

9.97E-08mmHg at 25°C

Computed Properties

Molecular Weight:235.31
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:235.07793322
Monoisotopic Mass:235.07793322
Topological Polar Surface Area:89.3
Heavy Atom Count:16
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

Basic Attributes
Characteristics
Computed Properties

5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

SDS

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