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138659-79-7 | Undecanoic acid, 6-[(aminocarbonyl)amino]-
CAS No: 138659-79-7 Catalog No: AG0018Z2 MDL No:
Product Description
Catalog Number:
AG0018Z2
Chemical Name:
Undecanoic acid, 6-[(aminocarbonyl)amino]-
CAS Number:
138659-79-7
Molecular Formula:
C12H24N2O3
Molecular Weight:
244.3306
IUPAC Name:
6-(carbamoylamino)undecanoic acid
InChI:
InChI=1S/C12H24N2O3/c1-2-3-4-7-10(14-12(13)17)8-5-6-9-11(15)16/h10H,2-9H2,1H3,(H,15,16)(H3,13,14,17)
InChI Key:
DYZYRHRGTAFFGL-UHFFFAOYSA-N
SMILES:
CCCCCC(NC(=O)N)CCCCC(=O)O
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.179g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
244.335g/mol
Monoisotopic Mass:
244.179g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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