AT-101

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Names

[ CAS No. ]:
90141-22-3

[ Name ]:
AT-101

[Synonym ]:
1,1',6,6',7,7'-Hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl[2,2'-binaphthalene]-8,8'-dicarboxaldehyde
UNII:XNA7DR63CQ
1,1',6,6',7,7'-Hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-dicarbaldehyde
UNII:8DY2X8LXW4
2,2'-Bis[1,6,7-trihydroxy-3-methyl-5-isopropyl-8-aldehydonaphthalene]
1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-8,8'-dicarbaldehyde
Gossypol
UNII:KAV15B369O
2,2'-bis[8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthalene]
(-)-1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde
1,1',6,6',7,7'-Hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalen-8,8'-dicarbaldehyd
[2,2'-Binaphthalene]-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-
1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-2,2'-binaphthalene-8,8'-dicarbaldehyde
1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde
AT-101

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
707.9±55.0 °C at 760 mmHg

[ Melting Point ]:
166-167ºC

[ Molecular Formula ]:
C30H30O8

[ Molecular Weight ]:
518.554

[ Flash Point ]:
395.9±28.0 °C

[ Exact Mass ]:
518.194092

[ PSA ]:
155.52000

[ LogP ]:
6.16

[ Vapour Pressure ]:
0.0±2.3 mmHg at 25°C

[ Index of Refraction ]:
1.742

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DU3103500
CHEMICAL NAME :
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl- 5,5'-bis(1-methylethyl)-, (-)-
CAS REGISTRY NUMBER :
90141-22-3
BEILSTEIN REFERENCE NO. :
1917878
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C30-H30-O8
MOLECULAR WEIGHT :
518.60

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
210 mg/kg
SEX/DURATION :
male 2 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count) Reproductive - Fertility - male fertility index (e.g. # males impregnating females per # males exposed to fertile nonpregnant females)
REFERENCE :
JOETD7 Journal of Ethnopharmacology. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1979- Volume(issue)/page/year: 20,21,1987
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
320 mg/kg
SEX/DURATION :
male 40 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Fertility - male fertility index (e.g. # males impregnating females per # males exposed to fertile nonpregnant females)
REFERENCE :
CCPTAY Contraception. (Geron-X, Inc., POB 1108, Los Altos, CA 94022) V.1- 1970- Volume(issue)/page/year: 31,141,1985

Safety Information

[ RIDADR ]:
NONH for all modes of transport

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Related Compounds

  • AT-101 (acetic acid)
  • AT-527
  • AT-273
  • AT-9010
  • AT 1902
  • AT-9283 L-lactate
  • 2'-(Trifluoromethoxy)-biphenyl-3-carbaldehyde
  • 3-Nitro-4-(thiophen-2-YL)benzoic acid
  • 3-Ethoxy-4-methoxy-5-phenylbenzoic acid
  • 6-Methoxy-2'-(trifluoromethoxy)biphenyl-3-carboxylic acid
  • 1-{4-Methoxy-3-[3-(trifluoromethyl)phenyl]phenyl}ethan-1-one
  • 4-Amino-2'-(trifluoromethoxy)-2-(trifluoromethyl)biphenyl
  • 4,5-Dimethoxy-2-(2-thienyl)benzaldehyde
  • 2-Hydroxy-3-methoxy-5-(2-thienyl)benzaldehyde
  • 6-Fluoro-3'-(trifluoromethyl)biphenyl-3-carbaldehyde
  • 4-Methoxy-2a(2)-(trifluoromethoxy)[1,1a(2)-biphenyl]-3-carboxaldehyde
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