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Home > Fluorides > 176380-53-3
176380-53-3 | Carbamic acid, N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-, 9H-fluoren-9-ylmethyl ester
CAS No: 176380-53-3 Catalog No: AG0024MQ MDL No:MFCD00270218
Product Description
Catalog Number:
AG0024MQ
Chemical Name:
Carbamic acid, N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-, 9H-fluoren-9-ylmethyl ester
CAS Number:
176380-53-3
Molecular Formula:
C19H21NO4
Molecular Weight:
327.3743
MDL Number:
MFCD00270218
IUPAC Name:
9H-fluoren-9-ylmethyl N-[(2R,3R)-1,3-dihydroxybutan-2-yl]carbamate
InChI:
InChI=1S/C19H21NO4/c1-12(22)18(10-21)20-19(23)24-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,12,17-18,21-22H,10-11H2,1H3,(H,20,23)/t12-,18-/m1/s1
InChI Key:
YOKDHMTZJSRRIQ-KZULUSFZSA-N
SMILES:
OC[C@H]([C@H](O)C)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
327.147g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
327.38g/mol
Monoisotopic Mass:
327.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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