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2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid

2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid structure

CAS No:
731001-98-2
Formula:
C12H13N3O3S
Chemical Name:
2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid
Synonyms:
Acetic acid,2-[[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]-;Acetic acid,[[4-(2-methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]-;2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid;2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl]acetic acid

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2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid Basic Attributes

Molecular Weight：

279.32 g/mol

Exact Mass：

279.31

Characteristics

PSA：

103 Å²

XLogP3：

1.761

Computed Properties

Molecular Weight:279.32
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:279.06776246
Monoisotopic Mass:279.06776246
Topological Polar Surface Area:103
Heavy Atom Count:19
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-(2-Methoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]thio]acetic acid

Basic Attributes
Characteristics
Computed Properties
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