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2978-11-2 | O-(4-NITROBENZYL)-N,N-DIISOPROPYLISOUREA
CAS No: 2978-11-2 Catalog No: AG003TEX MDL No:MFCD00042046
Product Description
Catalog Number:
AG003TEX
Chemical Name:
O-(4-NITROBENZYL)-N,N-DIISOPROPYLISOUREA
CAS Number:
2978-11-2
MDL Number:
MFCD00042046
IUPAC Name:
(4-nitrophenyl)methyl N,N'-di(propan-2-yl)carbamimidate
InChI:
InChI=1S/C14H21N3O3/c1-10(2)15-14(16-11(3)4)20-9-12-5-7-13(8-6-12)17(18)19/h5-8,10-11H,9H2,1-4H3,(H,15,16)
InChI Key:
FYDMCLCYYCIDMZ-UHFFFAOYSA-N
EC Number:
221-027-6
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.34g/mol
Monoisotopic Mass:
279.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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