Home Carboxys 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2,3-dihydro-1H-indene-5-carboxylic acid

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2,3-dihydro-1H-indene-5-carboxylic acid

CAS No.:
2137744-01-3
Catalog Number:
AG01EKYK
Molecular Formula:
C25H21NO4
Molecular Weight:
399.4385
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Product Description
Catalog Number:
AG01EKYK
Chemical Name:
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2,3-dihydro-1H-indene-5-carboxylic acid
CAS Number:
2137744-01-3
Molecular Formula:
C25H21NO4
Molecular Weight:
399.4385
MDL Number:
MFCD31421836
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-2,3-dihydro-1H-indene-5-carboxylic acid
InChI:
InChI=1S/C25H21NO4/c27-24(28)16-10-9-15-12-18(13-17(15)11-16)26-25(29)30-14-23-21-7-3-1-5-19(21)20-6-2-4-8-22(20)23/h1-11,18,23H,12-14H2,(H,26,29)(H,27,28)
InChI Key:
DWLVTLOPSTYFRV-UHFFFAOYSA-N
SMILES:
O=C(NC1Cc2c(C1)ccc(c2)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
629  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.147g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
399.446g/mol
Monoisotopic Mass:
399.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties