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146549-21-5 | 4-Pentenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-
CAS No: 146549-21-5 Catalog No: AG001E3Y MDL No:MFCD01311749
Product Description
Catalog Number:
AG001E3Y
Chemical Name:
4-Pentenoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-
CAS Number:
146549-21-5
Molecular Formula:
C20H19NO4
Molecular Weight:
337.3692
MDL Number:
MFCD01311749
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic acid
InChI:
InChI=1S/C20H19NO4/c1-2-7-18(19(22)23)21-20(24)25-12-17-15-10-5-3-8-13(15)14-9-4-6-11-16(14)17/h2-6,8-11,17-18H,1,7,12H2,(H,21,24)(H,22,23)/t18-/m0/s1
InChI Key:
YVBLQCANYSFEBN-SFHVURJKSA-N
SMILES:
C=CC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
337.131g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.375g/mol
Monoisotopic Mass:
337.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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