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OTAVA-BB1217676

OTAVA-BB1217676 structure

CAS No:
120711-81-1
Formula:
C8H8N2O3
Chemical Name:
OTAVA-BB1217676
Synonyms:
7-NITRO-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE;OTAVA-BB 1217676;7-Nitro-3,4-dihydro-2H-1,4-benzoxazine;7-Nitro-3,4-dihydro-2H-1,4-benzooxazine;7-Nitro-3,4-dihydrobenzo[1,4]oxazine;7-Nitro-3,4-dihydro-2H-benzo[1,4]oxazine;2H-1,4-Benzoxazine, 3,4-dihydro-7-nitro-;7-Nitro-3,4-dihydro-2H-1,4-benzoxazine,97%
Categories:
Chemical Reagents > Organic Reagents

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OTAVA-BB1217676 Basic Attributes

Molecular Weight：

180.16

Exact Mass：

180.05349212

DSSTox ID：

DTXSID90593572

HScode：

2934999090

Characteristics

PSA：

67.08000

XLogP3：

2.06030

Density：

1.332±0.06 g/cm3

Melting Point：

187-188°

Boiling Point：

341.6±42.0 °C(Predicted)

Water Solubility：

Sparingly soluble in water (0.76 g/L at 25°C).

PKA：

0.23±0.20

Safety Information

Hazard category：

IRRITANT

Transport codes：

UN 2811 6.1 / PGIII

hazard class code：

safety instructions：

Marks：

Computed Properties

Molecular Weight:180.16
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:180.05349212
Monoisotopic Mass:180.05349212
Topological Polar Surface Area:67.1
Heavy Atom Count:13
Complexity:204
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Manufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acid

120711-81-1 7-nitro-3,4-dihydro-2H-1,4-benzoxazine

CAS No.: 120711-81-1

Grade: Industrial Grade

Content: 95%

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