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Home > Nitro Compounds > 6558-78-7
6558-78-7 | N-n-butyl-N-nitrosourethane
CAS No: 6558-78-7 Catalog No: AG00F3VY MDL No:
Product Description
Catalog Number:
AG00F3VY
Chemical Name:
N-n-butyl-N-nitrosourethane
CAS Number:
6558-78-7
IUPAC Name:
ethyl N-butyl-N-nitrosocarbamate
InChI:
InChI=1S/C7H14N2O3/c1-3-5-6-9(8-11)7(10)12-4-2/h3-6H2,1-2H3
InChI Key:
RABAKMVAMFRJLX-UHFFFAOYSA-N
UNII:
Z4B03CU3G6
NSC Number:
123130
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.2g/mol
Monoisotopic Mass:
174.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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