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Home > Encyclopedia > BENZALDEHYDE-2,3,4,5,6-D5

BENZALDEHYDE-2,3,4,5,6-D5

BENZALDEHYDE-2,3,4,5,6-D5 structure

BENZALDEHYDE-2,3,4,5,6-D5 

structure
  • CAS No:

    17901-93-8

  • Formula:

    C7HD5O

  • Chemical Name:

    BENZALDEHYDE-2,3,4,5,6-D5

  • Synonyms:

    BENZALDEHYDE (RING-D5);BENZALDEHYDE-D5;BENZALDEHYDE-2,3,4,5,6-D5;BENZALDEHYDE-D6, 98 ATOM % D;BENZALDEHYDE (D6, 98%) (+0.1% HYDROQUINONE);deuterio-(2,3,4,5,6-pentadeuteriophenyl)methanone

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

BENZALDEHYDE-2,3,4,5,6-D5 Basic Attributes

111.15

106.041862

DTXSID40514616

Characteristics

17.07000

1.64

1.094 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

22-36/37/38-40-42/43

26-36-24

Xn

P264, P270, P301+P312, P330, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

BENZALDEHYDE-2,3,4,5,6-D5 Use and Manufacturing

Labeled Benzaldehyde , intended for use as an internal standard for the quantification of Benzaldehyde by GC- or LC-mass spectrometry.

Computed Properties

Molecular Weight:112.16
XLogP3:1.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:112.079525286
Monoisotopic Mass:112.079525286
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:72.5
Isotope Atom Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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