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102449-21-8 | 9H-Fluorene-9-carboxylic acid, 2-(1-methyl-2-pyrrolidinyl)ethyl ester
CAS No: 102449-21-8 Catalog No: AG0007IR MDL No:
Product Description
Catalog Number:
AG0007IR
Chemical Name:
9H-Fluorene-9-carboxylic acid, 2-(1-methyl-2-pyrrolidinyl)ethyl ester
CAS Number:
102449-21-8
Molecular Formula:
C21H23NO2
Molecular Weight:
321.4128
IUPAC Name:
2-(1-methylpyrrolidin-2-yl)ethyl 9H-fluorene-9-carboxylate
InChI:
InChI=1S/C21H23NO2/c1-22-13-6-7-15(22)12-14-24-21(23)20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h2-5,8-11,15,20H,6-7,12-14H2,1H3
InChI Key:
NIOZENOKDBIEHX-UHFFFAOYSA-N
SMILES:
O=C(C1c2ccccc2c2c1cccc2)OCCC1CCCN1C
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.173g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.42g/mol
Monoisotopic Mass:
321.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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