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Home > Boronic Acids > 104376-24-1
104376-24-1 | Pent-1-en-1-ylboronic acid
CAS No: 104376-24-1 Catalog No: AG003ELC MDL No:MFCD01074677
Product Description
Catalog Number:
AG003ELC
Chemical Name:
Pent-1-en-1-ylboronic acid
CAS Number:
104376-24-1
Molecular Formula:
C5H11BO2
Molecular Weight:
113.9506
MDL Number:
MFCD01074677
IUPAC Name:
[(E)-pent-1-enyl]boronic acid
InChI:
InChI=1S/C5H11BO2/c1-2-3-4-5-6(7)8/h4-5,7-8H,2-3H2,1H3/b5-4+
InChI Key:
SYKWJOZHNDPWIM-SNAWJCMRSA-N
SMILES:
CCC/C=C/B(O)O
Properties
Complexity:
70.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
114.085g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
113.951g/mol
Monoisotopic Mass:
114.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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