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Home > Encyclopedia > 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid

2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid

2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid structure

2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid 

structure
  • CAS No:

    200816-06-4

  • Formula:

    C5H7N3O2S

  • Chemical Name:

    2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid

2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid Basic Attributes

173.19300

173.02589765

DTXSID70362925

2933990090

Characteristics

93.31000

-0.00820

1.53g/cm3

414ºC at 760 mmHg

204.2ºC

1.675

1.35E-07mmHg at 25°C

Safety Information

Xi

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:173.20
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:173.02589765
Monoisotopic Mass:173.02589765
Topological Polar Surface Area:93.3
Heavy Atom Count:11
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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