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104216-36-6 | Carbamic acid, dimethyl-, 1H-indol-4-yl ester
CAS No: 104216-36-6 Catalog No: AG007YE4 MDL No:
Product Description
Catalog Number:
AG007YE4
Chemical Name:
Carbamic acid, dimethyl-, 1H-indol-4-yl ester
CAS Number:
104216-36-6
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
1H-indol-4-yl N,N-dimethylcarbamate
InChI:
InChI=1S/C11H12N2O2/c1-13(2)11(14)15-10-5-3-4-9-8(10)6-7-12-9/h3-7,12H,1-2H3
InChI Key:
CYSRRGLFJKNFHB-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Oc1cccc2c1cc[nH]2
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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