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89082-71-3 | 1-Buten-2-amine, 1-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-3-methyl-
CAS No: 89082-71-3 Catalog No: AG00408J MDL No:
Product Description
Catalog Number:
AG00408J
Chemical Name:
1-Buten-2-amine, 1-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-3-methyl-
CAS Number:
89082-71-3
Molecular Formula:
C10H18N2O
Molecular Weight:
182.2627
IUPAC Name:
1-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-methylbut-1-en-2-amine
InChI:
InChI=1S/C10H18N2O/c1-7(2)8(11)5-9-12-10(3,4)6-13-9/h5,7H,6,11H2,1-4H3
InChI Key:
CPZGBNAUCUKMHA-UHFFFAOYSA-N
SMILES:
NC(=CC1=NC(CO1)(C)C)C(C)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.267g/mol
Monoisotopic Mass:
182.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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