BENZYL-2,3,4,5,6-D5 ALCOHOL
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BENZYL-2,3,4,5,6-D5 ALCOHOL
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CAS No:
68661-10-9
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Formula:
C7H3D5O
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Chemical Name:
BENZYL-2,3,4,5,6-D5 ALCOHOL
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Synonyms:
Benzene-2,3,4,5,6-d5-methanol;BENZYL-2,3,4,5,6-D5 ALCOHOL;BENZYL-2,3,4,5,6-D5, ALCOHOL, 98 ATOM % D;Benzene-d5-methanol
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CAS No:
Characteristics
20.2
1.17890
1.094 g/mL at 25ºC
-16--13 °C(lit.)
203-205 °C(lit.)
213 °F
n20/D 1.539(lit.)
Safety Information
UN 3334
1
20/22
26
Xn
P261, P264, P270, P271, P301+P312, P304+P312, P304+P340, P312, P330, P501
H302-H332
Computed Properties
Molecular Weight:113.17
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:113.088898604
Monoisotopic Mass:113.088898604
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:55.4
Isotope Atom Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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