Home Aminos methyl 3-amino-3-(pyridin-4-yl)butanoate

methyl 3-amino-3-(pyridin-4-yl)butanoate

CAS No.:
1541050-78-5
Catalog Number:
AG01AFKW
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
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Product Description
Catalog Number:
AG01AFKW
Chemical Name:
methyl 3-amino-3-(pyridin-4-yl)butanoate
CAS Number:
1541050-78-5
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD23782331
IUPAC Name:
methyl 3-amino-3-pyridin-4-ylbutanoate
InChI:
InChI=1S/C10H14N2O2/c1-10(11,7-9(13)14-2)8-3-5-12-6-4-8/h3-6H,7,11H2,1-2H3
InChI Key:
MCQWPQSPVCNQAJ-UHFFFAOYSA-N
SMILES:
COC(=O)CC(c1ccncc1)(N)C
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties