Home Other Building Blocks 2-[3-(hydroxymethyl)phenoxy]propanoic acid

2-[3-(hydroxymethyl)phenoxy]propanoic acid

CAS No.:
149492-36-4
Catalog Number:
AG01A1IP
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
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Product Description
Catalog Number:
AG01A1IP
Chemical Name:
2-[3-(hydroxymethyl)phenoxy]propanoic acid
CAS Number:
149492-36-4
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
MDL Number:
MFCD16074970
IUPAC Name:
2-[3-(hydroxymethyl)phenoxy]propanoic acid
InChI:
InChI=1S/C10H12O4/c1-7(10(12)13)14-9-4-2-3-8(5-9)6-11/h2-5,7,11H,6H2,1H3,(H,12,13)
InChI Key:
MQNOWCALMQDTGZ-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)OC(C(=O)O)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.074g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.202g/mol
Monoisotopic Mass:
196.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties