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Home > Fluorides > 849472-67-9
849472-67-9 | Carbamic acid, (2-cyanoethyl)-, 9H-fluoren-9-ylmethyl ester
CAS No: 849472-67-9 Catalog No: AG004V6A MDL No:MFCD09953272
Product Description
Catalog Number:
AG004V6A
Chemical Name:
Carbamic acid, (2-cyanoethyl)-, 9H-fluoren-9-ylmethyl ester
CAS Number:
849472-67-9
Molecular Formula:
C18H16N2O2
Molecular Weight:
292.3318
MDL Number:
MFCD09953272
IUPAC Name:
9H-fluoren-9-ylmethyl N-(2-cyanoethyl)carbamate
InChI:
InChI=1S/C18H16N2O2/c19-10-5-11-20-18(21)22-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,11-12H2,(H,20,21)
InChI Key:
QBNVKEWYNPHDBR-UHFFFAOYSA-N
SMILES:
N#CCCNC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.338g/mol
Monoisotopic Mass:
292.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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