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1225218-93-8 | 5-(pyrrolidin-3-yl)isoxazole hydrochloride
CAS No: 1225218-93-8 Catalog No: AG00AA11 MDL No:
Product Description
Catalog Number:
AG00AA11
Chemical Name:
5-(pyrrolidin-3-yl)isoxazole hydrochloride
CAS Number:
1225218-93-8
IUPAC Name:
5-pyrrolidin-3-yl-1,2-oxazole
InChI:
InChI=1S/C7H10N2O/c1-3-8-5-6(1)7-2-4-9-10-7/h2,4,6,8H,1,3,5H2
InChI Key:
ZQCMJHCSXCMVNR-UHFFFAOYSA-N
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.17g/mol
Monoisotopic Mass:
138.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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