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Home > Fluorides > 161529-13-1

161529-13-1

161529-13-1 | Carbamic acid, N-[(1S)-2-hydroxy-1-methylethyl]-, 9H-fluoren-9-ylmethyl ester

CAS No: 161529-13-1 Catalog No: AG001VNV MDL No:MFCD00235913

Product Description

Catalog Number:
AG001VNV
Chemical Name:
Carbamic acid, N-[(1S)-2-hydroxy-1-methylethyl]-, 9H-fluoren-9-ylmethyl ester
CAS Number:
161529-13-1
Molecular Formula:
C18H19NO3
Molecular Weight:
297.3484
MDL Number:
MFCD00235913
IUPAC Name:
9H-fluoren-9-ylmethyl N-[(2S)-1-hydroxypropan-2-yl]carbamate
InChI:
InChI=1S/C18H19NO3/c1-12(10-20)19-18(21)22-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,12,17,20H,10-11H2,1H3,(H,19,21)/t12-/m0/s1
InChI Key:
GIZCEJUGNDJXMH-LBPRGKRZSA-N
SMILES:
OC[C@@H](NC(=O)OCC1c2ccccc2c2c1cccc2)C

Properties

Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
297.136g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.354g/mol
Monoisotopic Mass:
297.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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