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115296-89-4 | Pentanoic acid, 5-(nitrosopentylamino)-
CAS No: 115296-89-4 Catalog No: AG000GKE MDL No:
Product Description
Catalog Number:
AG000GKE
Chemical Name:
Pentanoic acid, 5-(nitrosopentylamino)-
CAS Number:
115296-89-4
Molecular Formula:
C10H20N2O3
Molecular Weight:
216.2774
IUPAC Name:
5-[nitroso(pentyl)amino]pentanoic acid
InChI:
InChI=1S/C10H20N2O3/c1-2-3-5-8-12(11-15)9-6-4-7-10(13)14/h2-9H2,1H3,(H,13,14)
InChI Key:
ARYBPZHPQNHJNT-UHFFFAOYSA-N
SMILES:
O=NCCCCCNCCCCC(=O)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.147g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.281g/mol
Monoisotopic Mass:
216.147g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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