Benzaldehyde, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-|29122-74-5,AngeneChemical

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Benzaldehyde, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-

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Chemical Name:	Benzaldehyde, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-
CAS Number:	29122-74-5
Product Number:	AG002XEY(AGN-PC-00NBMB)
Synonyms:
MDL No:
Molecular Formula:	C13H19NO3
Molecular Weight:	237.2949

Identification/Properties
Safety Information
NMR Spectrum
Other Analytical Data
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Identification/Properties

Computed Properties

Molecular Weight:

237.299g/mol

XLogP3:

1.2

Hydrogen Bond Donor Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

Exact Mass:

237.136g/mol

Monoisotopic Mass:

237.136g/mol

Topological Polar Surface Area:

58.6A^2

Heavy Atom Count:

Formal Charge:

Complexity:

213

Isotope Atom Count:

Defined Atom Stereocenter Count:

Undefined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Undefined Bond Stereocenter Count:

Covalently-Bonded Unit Count:

Compound Is Canonicalized:

Yes

Safety Information

GHS Pictogram:

Signal Word:

Warning

UN#:

N/A

Hazard Statements:

H319

Precautionary Statements:

P305+P351+P338

Class:

N/A

Packing Group:

N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure

The chemical structure of Benzaldehyde, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]- (C13H19NO3) is as follows:

```
    O
    ||
H-C-C-O-CH(CH3)-CH2-N(CH3)C2H5
   | | |  |
H-C-C-C-C-H
   | | | |
H-C-C-C-C-H
   | | | |
H-C-C-C-C-H
   | | | |
   Ph H H H
```

This structure represents benzaldehyde with a 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy] substituent attached.