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Home > Fluorides > 247021-90-5
247021-90-5 | β-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methoxy-
CAS No: 247021-90-5 Catalog No: AG002P3A MDL No:MFCD01861163
Product Description
Catalog Number:
AG002P3A
Chemical Name:
β-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methoxy-
CAS Number:
247021-90-5
Molecular Formula:
C19H19NO5
Molecular Weight:
341.3579
MDL Number:
MFCD01861163
IUPAC Name:
3-[9H-fluoren-9-ylmethoxycarbonyl(methoxy)amino]propanoic acid
InChI:
InChI=1S/C19H19NO5/c1-24-20(11-10-18(21)22)19(23)25-12-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-12H2,1H3,(H,21,22)
InChI Key:
ROUNCJXPHYHPTH-UHFFFAOYSA-N
SMILES:
CON(C(=O)OCC1c2ccccc2c2c1cccc2)CCC(=O)O
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
341.363g/mol
Monoisotopic Mass:
341.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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