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1803581-17-0 | 5-methyl-3-(pyrrolidin-2-yl)-1,2-oxazole hydrochloride
CAS No: 1803581-17-0 Catalog No: AG01B1RZ MDL No:MFCD27980971
Product Description
Catalog Number:
AG01B1RZ
Chemical Name:
5-methyl-3-(pyrrolidin-2-yl)-1,2-oxazole hydrochloride
CAS Number:
1803581-17-0
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
MDL Number:
MFCD27980971
IUPAC Name:
5-methyl-3-pyrrolidin-2-yl-1,2-oxazole;hydrochloride
InChI:
InChI=1S/C8H12N2O.ClH/c1-6-5-8(10-11-6)7-3-2-4-9-7;/h5,7,9H,2-4H2,1H3;1H
InChI Key:
LOPSWGJOXXDQSO-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)C1CCCN1.Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.072g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.655g/mol
Monoisotopic Mass:
188.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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