Home Other Building Blocks β-Alanine, N-(2-furanylmethyl)-, ethyl ester

β-Alanine, N-(2-furanylmethyl)-, ethyl ester

CAS No.:
175203-83-5
Catalog Number:
AG0020L1
Molecular Formula:
C10H15NO3
Molecular Weight:
197.2310
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Product Description
Catalog Number:
AG0020L1
Chemical Name:
β-Alanine, N-(2-furanylmethyl)-, ethyl ester
CAS Number:
175203-83-5
Molecular Formula:
C10H15NO3
Molecular Weight:
197.2310
MDL Number:
MFCD00219838
IUPAC Name:
ethyl 3-(furan-2-ylmethylamino)propanoate
InChI:
InChI=1S/C10H15NO3/c1-2-13-10(12)5-6-11-8-9-4-3-7-14-9/h3-4,7,11H,2,5-6,8H2,1H3
InChI Key:
CUWYCUOEHDOVAJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCNCc1ccco1
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.234g/mol
Monoisotopic Mass:
197.105g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties