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Home > Aldehydes > 111318-23-1
111318-23-1 | Acetaldehyde, [(1,1-dimethylethyl)nitrosoamino]-
CAS No: 111318-23-1 Catalog No: AG007T5X MDL No:
Product Description
Catalog Number:
AG007T5X
Chemical Name:
Acetaldehyde, [(1,1-dimethylethyl)nitrosoamino]-
CAS Number:
111318-23-1
Molecular Formula:
C6H12N2O2
Molecular Weight:
144.1717
IUPAC Name:
N-tert-butyl-N-(2-oxoethyl)nitrous amide
InChI:
InChI=1S/C6H12N2O2/c1-6(2,3)8(7-10)4-5-9/h5H,4H2,1-3H3
InChI Key:
JIBUEUFFOAFBLY-UHFFFAOYSA-N
SMILES:
O=CCN(C(C)(C)C)N=O
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.09g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.174g/mol
Monoisotopic Mass:
144.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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