Home Aminos 3-amino-2-((3,8-dimethoxynaphthalen-2-yl)methyl)propanoic acid

3-amino-2-((3,8-dimethoxynaphthalen-2-yl)methyl)propanoic acid

CAS No.:
288389-24-2
Catalog Number:
AG00BF5C
Molecular Formula:
C16H19NO4
Molecular Weight:
289.3264
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Product Description
Catalog Number:
AG00BF5C
Chemical Name:
3-amino-2-((3,8-dimethoxynaphthalen-2-yl)methyl)propanoic acid
CAS Number:
288389-24-2
Molecular Formula:
C16H19NO4
Molecular Weight:
289.3264
MDL Number:
MFCD28359469
IUPAC Name:
2-(aminomethyl)-3-(3,8-dimethoxynaphthalen-2-yl)propanoic acid
InChI:
InChI=1S/C16H19NO4/c1-20-14-5-3-4-10-8-15(21-2)11(7-13(10)14)6-12(9-17)16(18)19/h3-5,7-8,12H,6,9,17H2,1-2H3,(H,18,19)
InChI Key:
LRWBNNQCDMJJAK-UHFFFAOYSA-N
SMILES:
NCC(C(=O)O)Cc1cc2c(OC)cccc2cc1OC
Properties
Complexity:
349  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.131g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
289.331g/mol
Monoisotopic Mass:
289.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties