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13269-47-1 | 3-Buten-2-ol, 1-amino-
CAS No: 13269-47-1 Catalog No: AG00110I MDL No:MFCD09260505
Product Description
Catalog Number:
AG00110I
Chemical Name:
3-Buten-2-ol, 1-amino-
CAS Number:
13269-47-1
Molecular Formula:
C4H9NO
Molecular Weight:
87.1204
MDL Number:
MFCD09260505
IUPAC Name:
1-aminobut-3-en-2-ol
InChI:
InChI=1S/C4H9NO/c1-2-4(6)3-5/h2,4,6H,1,3,5H2
InChI Key:
VEPSIZZAILVTSD-UHFFFAOYSA-N
SMILES:
NCC(C=C)O
NSC Number:
33061
Properties
Complexity:
44.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
87.068g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
87.122g/mol
Monoisotopic Mass:
87.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
Literature
| Title | Journal |
|---|---|
| Synthesis of DNA oligodeoxynucleotides containing structurally defined N6-(2-hydroxy-3-buten-1-yl)-adenine adducts of 3,4-epoxy-1-butene. | Chemico-biological interactions 20070320 |
| An efficient RCM-based synthesis of orthogonally protected meso-DAP and FK565. | The Journal of organic chemistry 20041210 |
| Following an ISES lead: the first examples of asymmetric Ni(0)-mediated allylic amination. | Organic letters 20040805 |
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