Home Aminos 4-amino-3-(3-hydroxypropoxy)benzoic acid

4-amino-3-(3-hydroxypropoxy)benzoic acid

CAS No.:
1305431-42-8
Catalog Number:
AG01BVGN
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
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Product Description
Catalog Number:
AG01BVGN
Chemical Name:
4-amino-3-(3-hydroxypropoxy)benzoic acid
CAS Number:
1305431-42-8
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
MDL Number:
MFCD16072292
IUPAC Name:
4-amino-3-(3-hydroxypropoxy)benzoic acid
InChI:
InChI=1S/C10H13NO4/c11-8-3-2-7(10(13)14)6-9(8)15-5-1-4-12/h2-3,6,12H,1,4-5,11H2,(H,13,14)
InChI Key:
WFENBQVYXWRZBR-UHFFFAOYSA-N
SMILES:
OCCCOc1cc(ccc1N)C(=O)O
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties