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6-isocyano-2,3-dihydro-1,4-benzodioxine

6-isocyano-2,3-dihydro-1,4-benzodioxine structure

CAS No:
174092-82-1
Formula:
C9H7NO2
Chemical Name:
6-isocyano-2,3-dihydro-1,4-benzodioxine
Synonyms:
2,3-DIHYDRO-6-ISOCYANO-1,4-BENZODIOXINE; 2,3-DIBROMOPROPANOL; 2,3-Dihydro-6-Isocyano-1,4-Benzodioxin; 6-Isocyano-4-oxachromane;

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6-isocyano-2,3-dihydro-1,4-benzodioxine Basic Attributes

Molecular Weight：

161.15700

Exact Mass：

161.047678466

DSSTox ID：

DTXSID60370514

Characteristics

PSA：

18.46000

XLogP3：

1.23930

Appearance：

yellow to brown powder or chunks

Melting Point：

81-87ºC

Storage Conditions：

Refrigerator (+4ºC)

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26-S36-S37-S39

Marks：

Computed Properties

Molecular Weight:161.16
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Exact Mass:161.047678466
Monoisotopic Mass:161.047678466
Topological Polar Surface Area:22.8
Heavy Atom Count:12
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-isocyano-2,3-dihydro-1,4-benzodioxine

Basic Attributes
Characteristics
Safety Information
Computed Properties

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