Home Other Building Blocks 3-Methoxyphenylglyoxal hydrate

3-Methoxyphenylglyoxal hydrate

CAS No.:
1201806-19-0
Catalog Number:
AG00HFA5
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$63
- +
5g
96%
In Stock USA
United States
$175
- +
10g
96%
In Stock USA
United States
$338
- +
25g
96%
In Stock USA
United States
$682
- +
Product Description
Catalog Number:
AG00HFA5
Chemical Name:
3-Methoxyphenylglyoxal hydrate
CAS Number:
1201806-19-0
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD05664093
IUPAC Name:
2,2-dihydroxy-1-(3-methoxyphenyl)ethanone
InChI:
InChI=1S/C9H10O4/c1-13-7-4-2-3-6(5-7)8(10)9(11)12/h2-5,9,11-12H,1H3
InChI Key:
ROXUNLVBVNVHHH-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(=O)C(O)O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties