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62178-60-3 | NITROSOLANDRIN
CAS No: 62178-60-3 Catalog No: AG00F58N MDL No:
Product Description
Catalog Number:
AG00F58N
Chemical Name:
NITROSOLANDRIN
CAS Number:
62178-60-3
IUPAC Name:
(2,3,4-trimethylphenyl) N-methyl-N-nitrosocarbamate
InChI:
InChI=1S/C11H14N2O3/c1-7-5-6-10(9(3)8(7)2)16-11(14)13(4)12-15/h5-6H,1-4H3
InChI Key:
BOMIVRYJPJDQRT-UHFFFAOYSA-N
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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