Home Aminos methyl 3-{[(3,4-difluorophenyl)methyl]amino}propanoate

methyl 3-{[(3,4-difluorophenyl)methyl]amino}propanoate

CAS No.:
1152548-66-7
Catalog Number:
AG01AH9N
Molecular Formula:
C11H13F2NO2
Molecular Weight:
229.2232
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AH9N
Chemical Name:
methyl 3-{[(3,4-difluorophenyl)methyl]amino}propanoate
CAS Number:
1152548-66-7
Molecular Formula:
C11H13F2NO2
Molecular Weight:
229.2232
MDL Number:
MFCD11102609
IUPAC Name:
methyl 3-[(3,4-difluorophenyl)methylamino]propanoate
InChI:
InChI=1S/C11H13F2NO2/c1-16-11(15)4-5-14-7-8-2-3-9(12)10(13)6-8/h2-3,6,14H,4-5,7H2,1H3
InChI Key:
VUSVBPSGPNINFQ-UHFFFAOYSA-N
SMILES:
COC(=O)CCNCc1ccc(c(c1)F)F
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.091g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.227g/mol
Monoisotopic Mass:
229.091g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties