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Home > Boronic Acids > 1072952-16-9
1072952-16-9 | Hex-5-en-1-ylboronic acid
CAS No: 1072952-16-9 Catalog No: AG003QVC MDL No:MFCD10567048
Product Description
Catalog Number:
AG003QVC
Chemical Name:
Hex-5-en-1-ylboronic acid
CAS Number:
1072952-16-9
Molecular Formula:
C6H13BO2
Molecular Weight:
127.9772
MDL Number:
MFCD10567048
IUPAC Name:
hex-5-enylboronic acid
InChI:
InChI=1S/C6H13BO2/c1-2-3-4-5-6-7(8)9/h2,8-9H,1,3-6H2
InChI Key:
JXFKAWIGNACKQN-UHFFFAOYSA-N
SMILES:
C=CCCCCB(O)O
Properties
Complexity:
73.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.101g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.978g/mol
Monoisotopic Mass:
128.101g/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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