Home Halogens 4-chloro-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pent-4-enoic acid

4-chloro-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pent-4-enoic acid

CAS No.:
2059934-88-0
Catalog Number:
AG01BXVA
Molecular Formula:
C20H18ClNO4
Molecular Weight:
371.8142
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Product Description
Catalog Number:
AG01BXVA
Chemical Name:
4-chloro-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pent-4-enoic acid
CAS Number:
2059934-88-0
Molecular Formula:
C20H18ClNO4
Molecular Weight:
371.8142
MDL Number:
MFCD30497718
IUPAC Name:
4-chloro-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic acid
InChI:
InChI=1S/C20H18ClNO4/c1-12(21)10-18(19(23)24)22-20(25)26-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17-18H,1,10-11H2,(H,22,25)(H,23,24)
InChI Key:
GSTLADHJUCJPFT-UHFFFAOYSA-N
SMILES:
ClC(=C)CC(C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
530  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.092g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
371.817g/mol
Monoisotopic Mass:
371.092g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties