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137833-37-5 | 1(6H)-Pyridazinebutanoic acid, 6-amino-
CAS No: 137833-37-5 Catalog No: AG0013WZ MDL No:
Product Description
Catalog Number:
AG0013WZ
Chemical Name:
1(6H)-Pyridazinebutanoic acid, 6-amino-
CAS Number:
137833-37-5
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
IUPAC Name:
4-(3-amino-3H-pyridazin-2-yl)butanoic acid
InChI:
InChI=1S/C8H13N3O2/c9-7-3-1-5-10-11(7)6-2-4-8(12)13/h1,3,5,7H,2,4,6,9H2,(H,12,13)
InChI Key:
HAJKFINHROBWLJ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCN1N=CC=CC1N
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.101g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.211g/mol
Monoisotopic Mass:
183.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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