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

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

CAS No:
123216-99-9
Formula:
C11H13N3OS
Chemical Name:
5-[(3,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

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

Molecular Weight：

235.30500

Exact Mass：

235.07793322 g/mol

DSSTox ID：

DTXSID10350664

HScode：

2934999090

Characteristics

PSA：

90.00000

XLogP3：

2.24620

Density：

1.272g/cm3

Boiling Point：

442ºC

Flash Point：

221.1ºC

Refractive Index：

1.631

Water Solubility：

4.2 [ug/mL]

Vapor Pressure：

5.22E-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-[(3,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

Basic Attributes
Characteristics
Computed Properties

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