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4-BUTYL-5-METHYL-3-ISOXAZOLOL

4-BUTYL-5-METHYL-3-ISOXAZOLOL structure

CAS No:
96520-39-7
Formula:
C8H13NO2
Chemical Name:
4-BUTYL-5-METHYL-3-ISOXAZOLOL
Synonyms:
4-butyl-5-methyl-3-isoxazolol;4-butyl-5-methyl-1,2-oxazol-3-ol;4-butyl-5-methylisoxazol-3-ol;4-butyl-5-methyl-1,2-oxazol-3-one;CTK5H8766;KS-00001XXH;DTXSID40377283;ZINC2580709;4527AF;SBB087077

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4-BUTYL-5-METHYL-3-ISOXAZOLOL Basic Attributes

Molecular Weight：

155.19

Exact Mass：

155.09500

DSSTox ID：

DTXSID40377283

HScode：

2934999090

Characteristics

PSA：

38.3

XLogP3：

2.03120

Density：

1.02g/cm3

Boiling Point：

268.4ºC at 760mmHg

Flash Point：

116.1ºC

Refractive Index：

1.461

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:155.19
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:155.094628657
Monoisotopic Mass:155.094628657
Topological Polar Surface Area:38.3
Heavy Atom Count:11
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-BUTYL-5-METHYL-3-ISOXAZOLOL

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-BUTYL-5-METHYL-3-ISOXAZOLOL

SDS

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