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1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI)

1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI) structure

CAS No:
648448-98-0
Formula:
C9H7NO2
Chemical Name:
1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI)
Synonyms:
3-methylbenzo[d]isoxazole-5-carbaldehyde;3-Methyl-benzo[d]isoxazole-5-carbaldehyde;3-Methyl-1,2-benzoxazole-5-carbaldehyde;1,2-Benzisoxazole-5-carboxaldehyde, 3-methyl-;SCHEMBL2877358;CTK2A2342;DTXSID20724110;2355AJ;ZINC82405214;SB38121

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1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI) Basic Attributes

Molecular Weight：

161.15738

Exact Mass：

161.04800

DSSTox ID：

DTXSID20724110

HScode：

2934999090

Characteristics

PSA：

43.10000

XLogP3：

1.94870

Computed Properties

Molecular Weight:161.16
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:161.047678466
Monoisotopic Mass:161.047678466
Topological Polar Surface Area:43.1
Heavy Atom Count:12
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI)

Basic Attributes
Characteristics
Computed Properties

1,2-Benzisoxazole-5-carboxaldehyde,3-methyl-(9CI)

SDS

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