Home Other Building Blocks 4-(2,2-dimethylmorpholin-4-yl)benzoic acid hydrochloride

4-(2,2-dimethylmorpholin-4-yl)benzoic acid hydrochloride

CAS No.:
2059975-31-2
Catalog Number:
AG01C036
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
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Product Description
Catalog Number:
AG01C036
Chemical Name:
4-(2,2-dimethylmorpholin-4-yl)benzoic acid hydrochloride
CAS Number:
2059975-31-2
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
MDL Number:
MFCD30497799
IUPAC Name:
4-(2,2-dimethylmorpholin-4-yl)benzoic acid;hydrochloride
InChI:
InChI=1S/C13H17NO3.ClH/c1-13(2)9-14(7-8-17-13)11-5-3-10(4-6-11)12(15)16;/h3-6H,7-9H2,1-2H3,(H,15,16);1H
InChI Key:
BMKYKNVAWYAPPR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)N1CCOC(C1)(C)C.Cl
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.741g/mol
Monoisotopic Mass:
271.098g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties