Aristolochic acid II
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Aristolochic acid II
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CAS No:
475-80-9
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Formula:
C16H9NO6
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Chemical Name:
Aristolochic acid II
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Synonyms:
Phenanthro[3,4-d]-1,3-dioxole-5-carboxylic acid,6-nitro-;Aristolochic acid II;6-Nitrophenanthro[3,4-d]-1,3-dioxole-5-carboxylic acid;3,4-(Methylenedioxy)-10-nitrophenanthrene-1-carboxylic acid;Aristolochic acid B;79468-63-6
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CAS No:
Description
Aristolochic acid B is one of the major components of Aristolochic acids (AA) which are natural products derived from taxa in the Aristolochiaceae. Aristolochic acid is known to be a potent mutagen and carcinogen. Aristolochic acid B showes more carcinogenic risk than Aristolochic acid A in vivo[1].
Characteristics
101.58000
3.50
1.6±0.1 g/cm3
269-271 °C (decomp)
592.2±50.0 °C at 760 mmHg
311.9±30.1 °C
1.787
7.2E-15mmHg at 25°C
Safety Information
III
6.1(b)
2811
P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P308+P313, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, P501
H301
Aristolochic acid II Use and Manufacturing
Aristolochic acids occur in Aristolochiaceae and in butterflies feeding on these plants. One of a group of fourteen known, substituted 1-phenanthrenecarboxylic acids
Computed Properties
Molecular Weight:311.24
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:311.04298701
Monoisotopic Mass:311.04298701
Topological Polar Surface Area:102
Heavy Atom Count:23
Complexity:505
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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