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Home > Nitro Compounds > 102631-85-6
102631-85-6 | Morpholine, 4-(2-nitro-1-propen-1-yl)-
CAS No: 102631-85-6 Catalog No: AG0007Z1 MDL No:
Product Description
Catalog Number:
AG0007Z1
Chemical Name:
Morpholine, 4-(2-nitro-1-propen-1-yl)-
CAS Number:
102631-85-6
Molecular Formula:
C7H12N2O3
Molecular Weight:
172.1818
IUPAC Name:
4-(2-nitroprop-1-enyl)morpholine
InChI:
InChI=1S/C7H12N2O3/c1-7(9(10)11)6-8-2-4-12-5-3-8/h6H,2-5H2,1H3
InChI Key:
QDFFEVUNLGYYDG-UHFFFAOYSA-N
SMILES:
CC(=CN1CCOCC1)[N+](=O)[O-]
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.085g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.184g/mol
Monoisotopic Mass:
172.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.5
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