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161125-36-6

161125-36-6 | Propanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-hydroxy-

CAS No: 161125-36-6 Catalog No: AG001S6O MDL No:MFCD00672327

Product Description

Catalog Number:
AG001S6O
Chemical Name:
Propanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2-hydroxy-
CAS Number:
161125-36-6
Molecular Formula:
C18H17NO5
Molecular Weight:
327.3313
MDL Number:
MFCD00672327
IUPAC Name:
3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-hydroxypropanoic acid
InChI:
InChI=1S/C18H17NO5/c20-16(17(21)22)9-19-18(23)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16,20H,9-10H2,(H,19,23)(H,21,22)
InChI Key:
OOFCRVWLJFLVCB-UHFFFAOYSA-N
SMILES:
O=C(OCC1c2ccccc2c2c1cccc2)NCC(C(=O)O)O

Properties

Complexity:
446  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.111g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
327.336g/mol
Monoisotopic Mass:
327.111g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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