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15158-22-2 | 3-Buten-2-ol, 1-amino-2-methyl-
CAS No: 15158-22-2 Catalog No: AG001NF4 MDL No:
Product Description
Catalog Number:
AG001NF4
Chemical Name:
3-Buten-2-ol, 1-amino-2-methyl-
CAS Number:
15158-22-2
Molecular Formula:
C5H11NO
Molecular Weight:
101.1469
IUPAC Name:
1-amino-2-methylbut-3-en-2-ol
InChI:
InChI=1S/C5H11NO/c1-3-5(2,7)4-6/h3,7H,1,4,6H2,2H3
InChI Key:
HIZLKTYBQGWVMQ-UHFFFAOYSA-N
SMILES:
CC(C=C)(CN)O
Properties
Complexity:
72.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.084g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
101.149g/mol
Monoisotopic Mass:
101.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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