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Home > Encyclopedia > 2-(4-bromo-5-methylpyrazol-1-yl)acetic acid

2-(4-bromo-5-methylpyrazol-1-yl)acetic acid

2-(4-bromo-5-methylpyrazol-1-yl)acetic acid structure

2-(4-bromo-5-methylpyrazol-1-yl)acetic acid 

structure
  • CAS No:

    512809-63-1

  • Formula:

    C6H7BrN2O2

  • Chemical Name:

    2-(4-bromo-5-methylpyrazol-1-yl)acetic acid

  • Synonyms:

    2-(4-bromo-5-methylpyrazolyl)acetic acid; (4-bromo-5-methyl-1H-pyrazol-1-yl)acetic acid;

2-(4-bromo-5-methylpyrazol-1-yl)acetic acid Basic Attributes

219.03600

217.96909

DTXSID30392187

2933199090

Characteristics

55.12000

1.03860

1.79g/cm3

361.3ºC

172.3ºC

1.634

Safety Information

|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:219.04
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:217.96909
Monoisotopic Mass:217.96909
Topological Polar Surface Area:55.1
Heavy Atom Count:11
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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