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Home > Indoles and Oxindole > 20948-96-3
20948-96-3 | Carbamic acid, N-1H-indol-2-yl-, phenylmethyl ester
CAS No: 20948-96-3 Catalog No: AG002K9K MDL No:
Product Description
Catalog Number:
AG002K9K
Chemical Name:
Carbamic acid, N-1H-indol-2-yl-, phenylmethyl ester
CAS Number:
20948-96-3
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
IUPAC Name:
benzyl N-(1H-indol-2-yl)carbamate
InChI:
InChI=1S/C16H14N2O2/c19-16(20-11-12-6-2-1-3-7-12)18-15-10-13-8-4-5-9-14(13)17-15/h1-10,17H,11H2,(H,18,19)
InChI Key:
HEINMWFSDAZYPO-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc2c([nH]1)cccc2)OCc1ccccc1
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.3g/mol
Monoisotopic Mass:
266.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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