Home Nitros 3-nitro-4-(propan-2-yl)-1H-pyrrole

3-nitro-4-(propan-2-yl)-1H-pyrrole

CAS No.:
1195619-32-9
Catalog Number:
AG01BK6I
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
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Product Description
Catalog Number:
AG01BK6I
Chemical Name:
3-nitro-4-(propan-2-yl)-1H-pyrrole
CAS Number:
1195619-32-9
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD28666876
IUPAC Name:
3-nitro-4-propan-2-yl-1H-pyrrole
InChI:
InChI=1S/C7H10N2O2/c1-5(2)6-3-8-4-7(6)9(10)11/h3-5,8H,1-2H3
InChI Key:
UUZXWBHCTVLAON-UHFFFAOYSA-N
SMILES:
CC(c1c[nH]cc1[N+](=O)[O-])C
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties