Rutamarin

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Names

[ CAS No. ]:
14882-94-1

[ Name ]:
Rutamarin

[Synonym ]:
aspergillus acid A

Chemical & Physical Properties

[ Density]:
1.19g/cm3

[ Boiling Point ]:
471.1ºC at 760mmHg

[ Molecular Formula ]:
C21H24O5

[ Molecular Weight ]:
356.41200

[ Flash Point ]:
204.9ºC

[ Exact Mass ]:
356.16200

[ PSA ]:
65.74000

[ LogP ]:
3.90180

[ Vapour Pressure ]:
4.79E-09mmHg at 25°C

[ Index of Refraction ]:
1.555

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LV1045200
CHEMICAL NAME :
7H-Furo(3,2-g)(1)benzopyran-7-one, 2,3-dihydro-6-(1,1-dimethylallyl)-2-(1-hydroxy-1- methylethyl)-, acetate
CAS REGISTRY NUMBER :
14882-94-1
BEILSTEIN REFERENCE NO. :
1400300
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H24-O5
MOLECULAR WEIGHT :
356.45

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - mouse Ascites tumor
DOSE/DURATION :
15 mg/L
REFERENCE :
PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 31,351,1977

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one
  • Ethanoic anhydride
  • 3-Chloro-3-methyl-1-butyne
  • 7-hydroxy-8-iodochromen-2-one
  • 7-Hydroxycoumarine
  • 7-O-(1,1-dimethyl-2-propynyl)-8-iodo-2H-1-benzopyran-2-one
  • 7-hydroxy-3-(2-methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)chromen-2-one
  • 8-iodo-7-(2-methylbut-3-en-2-yloxy)chromen-2-one
  • 8-iododemethylsuberosin acetate
  • 8-iododemethylsuberosin

DownStream

Related Compounds

  • Rutamarin
  • 2-[7-(1-azepanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]-N~1~-(2,3-dimethylphenyl)acetamide
  • methyl 4-{2-[7-(azepan-1-yl)-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrimidin-2-yl]acetamido}benzoate
  • 2-[7-(1-azepanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]-N~1~-(3-chloro-4-methoxyphenyl)acetamide
  • methyl 2-({[7-(3-methylpiperidin-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetyl}amino)benzoate
  • 2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]-N~1~-(4-fluorophenyl)acetamide
  • N~1~-(2,5-difluorophenyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
  • N~1~-(3-chloro-4-methoxyphenyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
  • 2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]-N-(3-fluoro-4-methoxyphenyl)acetamide
  • 4-Bromo-N,N-diethylpyrimidin-2-amine
  • N~1~-(2-chloro-4-fluorobenzyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
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