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Home > Boronic Acids > 214907-33-2
214907-33-2 | (4-Methylpent-1-en-1-yl)boronic acid
CAS No: 214907-33-2 Catalog No: AG003BWE MDL No:MFCD01074680
Product Description
Catalog Number:
AG003BWE
Chemical Name:
(4-Methylpent-1-en-1-yl)boronic acid
CAS Number:
214907-33-2
Molecular Formula:
C6H13BO2
Molecular Weight:
127.9772
MDL Number:
MFCD01074680
IUPAC Name:
[(E)-4-methylpent-1-enyl]boronic acid
InChI:
InChI=1S/C6H13BO2/c1-6(2)4-3-5-7(8)9/h3,5-6,8-9H,4H2,1-2H3/b5-3+
InChI Key:
OLTGERMANPOCTC-HWKANZROSA-N
SMILES:
OB(/C=C/CC(C)C)O
Properties
Complexity:
89.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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