Home Other Building Blocks 4-Methylphenylglyoxal hydrate

4-Methylphenylglyoxal hydrate

CAS No.:
16208-14-3
Catalog Number:
AG001SPK
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$150
- +
10g
97%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG001SPK
Chemical Name:
4-Methylphenylglyoxal hydrate
CAS Number:
16208-14-3
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00234532
IUPAC Name:
2-(4-methylphenyl)-2-oxoacetaldehyde;hydrate
InChI:
InChI=1S/C9H8O2.H2O/c1-7-2-4-8(5-3-7)9(11)6-10;/h2-6H,1H3;1H2
InChI Key:
GXHQJKVATXFHBV-UHFFFAOYSA-N
SMILES:
OC(C(=O)c1ccc(cc1)C)O
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties