Home Other Building Blocks 4-(3-hydroxypropoxy)benzoic acid

4-(3-hydroxypropoxy)benzoic acid

CAS No.:
46350-87-2
Catalog Number:
AG01E66P
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
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Product Description
Catalog Number:
AG01E66P
Chemical Name:
4-(3-hydroxypropoxy)benzoic acid
CAS Number:
46350-87-2
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
MDL Number:
MFCD11204894
IUPAC Name:
4-(3-hydroxypropoxy)benzoic acid
InChI:
InChI=1S/C10H12O4/c11-6-1-7-14-9-4-2-8(3-5-9)10(12)13/h2-5,11H,1,6-7H2,(H,12,13)
InChI Key:
MYGMROGVZNOWMY-UHFFFAOYSA-N
SMILES:
OCCCOc1ccc(cc1)C(=O)O
EC Number:
918-767-3
Properties
Complexity:
173  
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:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties