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Home > Boronic Acids > 57404-76-9
57404-76-9 | TRANS-HEPTENYLBORONIC ACID
CAS No: 57404-76-9 Catalog No: AG00EBMS MDL No:MFCD01074600
Product Description
Catalog Number:
AG00EBMS
Chemical Name:
TRANS-HEPTENYLBORONIC ACID
CAS Number:
57404-76-9
Molecular Formula:
C7H15BO2
Molecular Weight:
142.0038
MDL Number:
MFCD01074600
IUPAC Name:
[(E)-hept-1-enyl]boronic acid
InChI:
InChI=1S/C7H15BO2/c1-2-3-4-5-6-7-8(9)10/h6-7,9-10H,2-5H2,1H3/b7-6+
InChI Key:
LDTJUGVTOZBIBN-VOTSOKGWSA-N
SMILES:
CCCCC/C=C/B(O)O
Properties
Complexity:
91.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
142.117g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.005g/mol
Monoisotopic Mass:
142.117g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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