BENZALDEHYDE-D6
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BENZALDEHYDE-D6
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CAS No:
14132-51-5
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Formula:
C7HD5O
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Chemical Name:
BENZALDEHYDE-D6
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Synonyms:
Benzaldehyde-d6;deuterio-(2,3,4,5,6-pentadeuteriophenyl)methanone;SCHEMBL1331284;(formyl-~2~H_6_)Benzaldehyde;Benzaldehyde-d6, 98 atom % D;DTXSID40514616;AKOS015889552
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CAS No:
Characteristics
17.07000
1.64
1.103 g/mL at 25 °C
−26 °C(lit.)
178-179 °C(lit.)
145 °F
n 20/D 1.545(lit.)
Safety Information
UN 1990 9/PG 3
3
22-42/43-40-36/37/38
24-36-26
Xn
P264, P270, P301+P312, P330, P501
H302
Computed Properties
Molecular Weight:111.15
XLogP3:1.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:111.073248540
Monoisotopic Mass:111.073248540
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:72.5
Isotope Atom Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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