Home Aldehydes 4-Ethoxy-3-(hydroxymethyl)benzaldehyde hydrate

4-Ethoxy-3-(hydroxymethyl)benzaldehyde hydrate

CAS No.:
1559062-02-0
Catalog Number:
AG00J2YL
Molecular Formula:
C10H14O4
Molecular Weight:
198.2158
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00J2YL
Chemical Name:
4-Ethoxy-3-(hydroxymethyl)benzaldehyde hydrate
CAS Number:
1559062-02-0
Molecular Formula:
C10H14O4
Molecular Weight:
198.2158
MDL Number:
MFCD27966296
IUPAC Name:
4-ethoxy-3-(hydroxymethyl)benzaldehyde;hydrate
InChI:
InChI=1S/C10H12O3.H2O/c1-2-13-10-4-3-8(6-11)5-9(10)7-12;/h3-6,12H,2,7H2,1H3;1H2
InChI Key:
XNQVXWSRAZLCME-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1CO)C=O.O
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.089g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.218g/mol
Monoisotopic Mass:
198.089g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties