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2,1-Benzisoxazole

2,1-Benzisoxazole structure

CAS No:
271-58-9
Formula:
C7H5NO
Chemical Name:
2,1-Benzisoxazole
Synonyms:
2,1-Benzisoxazole;Anthranil;NSC 99331;Benz[a]isoxazole;2332895-74-4

Description

CLEAR YELLOW TO BROWN-RED LIQUID

2,1-benzoxazole is a benzoxazole in which the benzene ring is fused to a 1,2-oxazole ring across positions 3 and 4. It is a member of 2,1-benzoxazoles and a mancude organic heterobicyclic parent.

2,1-Benzisoxazole Basic Attributes

Molecular Weight：

119.12

Exact Mass：

119.12

EC Number：

205-980-5

UNII：

58GQ20G9W6

NSC Number：

99331

DSSTox ID：

DTXSID00181565

HScode：

29349990

Characteristics

PSA：

XLogP3：

1.5

Appearance：

Clear yellow to brown-red Liquid

Density：

1.183 g/mL at 25 °C(lit.)

Melting Point：

<-18 °C

Boiling Point：

215 °C

Flash Point：

201 °F

Refractive Index：

n20/D 1.584(lit.)

Safety Information

wgk germany：

hazard class code：

safety instructions：

24/25-25-24

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

anthranil

Computed Properties

Molecular Weight:119.12
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Exact Mass:119.037113783
Monoisotopic Mass:119.037113783
Topological Polar Surface Area:26
Heavy Atom Count:9
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,1-Benzisoxazole

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

2,1-Benzisoxazole

SDS

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