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115282-41-2

115282-41-2 | Benzeneacetic acid, 4-(dimethylamino)-α-hydroxy-

CAS No: 115282-41-2 Catalog No: AG000GJO MDL No:MFCD20640223

Product Description

Catalog Number:
AG000GJO
Chemical Name:
Benzeneacetic acid, 4-(dimethylamino)-α-hydroxy-
CAS Number:
115282-41-2
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD20640223
IUPAC Name:
2-[4-(dimethylamino)phenyl]-2-oxoacetaldehyde;hydrate
InChI:
InChI=1S/C10H11NO2.H2O/c1-11(2)9-5-3-8(4-6-9)10(13)7-12;/h3-7H,1-2H3;1H2
InChI Key:
YOKMNOZLZXDGBI-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)N(C)C)C(=O)O

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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