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Home > Fluorides > 138774-92-2
138774-92-2 | D-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-
CAS No: 138774-92-2 Catalog No: AG0019IP MDL No:MFCD00153385
Product Description
Catalog Number:
AG0019IP
Chemical Name:
D-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-
CAS Number:
138774-92-2
Molecular Formula:
C19H19NO4
Molecular Weight:
325.3585
MDL Number:
MFCD00153385
IUPAC Name:
(2R)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]propanoic acid
InChI:
InChI=1S/C19H19NO4/c1-12(18(21)22)20(2)19(23)24-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17H,11H2,1-2H3,(H,21,22)/t12-/m1/s1
InChI Key:
JOFHWKQIQLPZTC-GFCCVEGCSA-N
SMILES:
OC(=O)[C@H](N(C(=O)OCC1c2ccccc2c2c1cccc2)C)C
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
325.131g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.364g/mol
Monoisotopic Mass:
325.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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