Benzeneacetic acid, α,4-dihydroxy-3-(methoxy-d3)-
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Benzeneacetic acid, α,4-dihydroxy-3-(methoxy-d3)-
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CAS No:
74495-70-8
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Formula:
C9H7D3O5
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Chemical Name:
Benzeneacetic acid, α,4-dihydroxy-3-(methoxy-d3)-
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Synonyms:
Benzeneacetic acid,α,4-dihydroxy-3-(methoxy-d3)-
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CAS No:
Benzeneacetic acid, α,4-dihydroxy-3-(methoxy-d3)- Basic Attributes
201.19100
201.07165365
DTXSID20493910
Characteristics
86.99000
0.51880
Off-White Solid
1.463g/cm3
127-129 °C @ Solvent: Diethyl ether
421.328ºC
173.698ºC
1.606
Computed Properties
Molecular Weight:201.19
XLogP3:-0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:201.07165365
Monoisotopic Mass:201.07165365
Topological Polar Surface Area:87
Heavy Atom Count:14
Complexity:205
Isotope Atom Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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