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Home > Encyclopedia > 3-(Bromomethyl)-5-methylisoxazole

3-(Bromomethyl)-5-methylisoxazole

3-(Bromomethyl)-5-methylisoxazole structure

3-(Bromomethyl)-5-methylisoxazole 

structure
  • CAS No:

    130628-75-0

  • Formula:

    C5H6BrNO

  • Chemical Name:

    3-(Bromomethyl)-5-methylisoxazole

  • Synonyms:

    3-(BROMOMETHYL)-5-METHYLISOXAZOLE;Isoxazole, 3-(bromomethyl)-5-methyl- (9CI);3-(Bromomethyl)-5-methyl-1,2-oxazole;3-BroroMethyl-5-Methylisoxazole;3-BroMoMethyl-5-Methyl-isoxazole, 95+%

3-(Bromomethyl)-5-methylisoxazole Basic Attributes

176.01

174.96300

DTXSID70379972

2934999090

Characteristics

26

1.87790

1.582±0.06 g/cm3(Predicted)

44°C (0.4 mmHg)

92.2ºC

1.525

0.109mmHg at 25°C

Safety Information

IRRITANT

3265

34-36-22

26-36/37/39-45

C,Xn

Corrosive

P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302+H312+H332

|Danger|H302+H312+H332 (33.33%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:176.01
XLogP3:1.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:174.96328
Monoisotopic Mass:174.96328
Topological Polar Surface Area:26
Heavy Atom Count:8
Complexity:78.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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