Home Nitros tert-butylmethylnitrosamine

tert-butylmethylnitrosamine

CAS No.:
2504-18-9
Catalog Number:
AG00BVFV
Molecular Formula:
C5H12N2O
Molecular Weight:
116.1616
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Product Description
Catalog Number:
AG00BVFV
Chemical Name:
tert-butylmethylnitrosamine
CAS Number:
2504-18-9
Molecular Formula:
C5H12N2O
Molecular Weight:
116.1616
MDL Number:
MFCD01656537
IUPAC Name:
N-tert-butyl-N-methylnitrous amide
InChI:
InChI=1S/C5H12N2O/c1-5(2,3)7(4)6-8/h1-4H3
InChI Key:
YDNOESAJRGHRAE-UHFFFAOYSA-N
SMILES:
O=NN(C(C)(C)C)C
UNII:
GGC4CMK8EG
Properties
Complexity:
84.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.095g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.164g/mol
Monoisotopic Mass:
116.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties