diboa

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Names

[ CAS No. ]:
17359-54-5

[ Name ]:
diboa

[Synonym ]:
2,4-dihydroxy-1,4-benzoxazin-3-one
2H-1,4-BENZOXAZIN-3(4H)-ONE,2,4-DIHYDROXY
2,4-dihydroxy-2H-1,4-benzoxazin-3-one
4-hydroxy-2H-1,4-benzoxazin-3(4H)-one
2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one
2,4-Dihydroxy-1,4-benzoxazinone

Chemical & Physical Properties

[ Density]:
1.664g/cm3

[ Boiling Point ]:
405.1ºC at 760mmHg

[ Melting Point ]:
>153°C (dec.) (lit.)

[ Molecular Formula ]:
C8H7NO4

[ Molecular Weight ]:
181.14500

[ Flash Point ]:
198.8ºC

[ Exact Mass ]:
181.03800

[ PSA ]:
70.00000

[ LogP ]:
0.18460

[ Vapour Pressure ]:
2.74E-07mmHg at 25°C

[ Index of Refraction ]:
1.704

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DM3850000
CHEMICAL NAME :
2H-1,4-Benzoxazin-3(4H)-one, 2,4-dihydroxy-
CAS REGISTRY NUMBER :
17359-54-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H7-N-O4
MOLECULAR WEIGHT :
181.16
WISWESSER LINE NOTATION :
T66 BNV EO DHJ BQ DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
500 ug/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 66,191,1979

Safety Information

[ Hazard Codes ]:
Xi

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-hydroxy-1,4-benzoxazine-2,3-dione
  • 2-Bromo-4-hydroxy-2H-1,4-benzoxazin-3(4H)-one
  • ethyl 2-(2-nitrophenoxy)acetate
  • methyl α-(2-nitrophenoxy)-α-methoxyacetate
  • 4-HYDROXY-2H-1,4-BENZOXAZIN-3(4H)-ONE
  • potassium 2-nitrophenolate
  • 4-hydroxy-2-methoxy-1,4-benzoxazin-3-one
  • aminophenol

DownStream

  • 2-Benzoxazolinone

Related Compounds

  • DIBOA β-D-glucoside
  • 1,2-Dioleoyl-3-palmitoyl-sn-glycerol
  • 2-(3-Chloro-2-fluorophenyl)ethanimidamide
  • 3-Bromo-2-cyclopropoxybenzaldehyde
  • 4-Morpholinecarboxylic acid, 2-oxo-3-(2-oxoethyl)-5,6-diphenyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butyl]-, 1,1-dimethylethyl ester, (3R,5R,6S)-
  • (3R,3aS)-3-(Hydroxymethyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3a,4-dihydrobenzo[b]oxazolo[3,4-d][1,4]oxazin-1(3H)-one
  • 3-bromo-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxylic acid
  • (S)-2-chloro-5-((pyrrolidin-3-ylsulfonyl)methyl)pyridine hydrochloride
  • 3-(5-Oxaspiro[3.5]nonan-8-yloxy)azetidine
  • 3-{6-Oxa-2-thiaspiro[4.5]decan-9-yloxy}azetidine
  • 1-Oxaspiro[5.5]undecane-4-sulfonamide
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