n-Butylboronic acid

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Catalog Number
ACM4426475
Product Name
n-Butylboronic acid
Structure
Structure
CAS
4426-47-5
Category
Boronic Acids
Synonyms
1-Butyldihydroxyborane
IUPAC Name
butylboronic acid
Molecular Weight
101.94
Molecular Formula
C4H11BO2
Canonical SMILES
B(CCCC)(O)O
InChI
InChI=1S/C4H11BO2/c1-2-3-4-5(6)7/h6-7H,2-4H2,1H3
InChI Key
QPKFVRWIISEVCW-UHFFFAOYSA-N
Boiling Point
189.2±23.0 °C
Melting Point
90-92 °C (lit.)
Density
1.022 g/ml
Complexity
38.7
Covalently-Bonded Unit Count
1
EC Number
224-607-7
Exact Mass
102.08521g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
7
Monoisotopic Mass
102.08521g/mol
Rotatable Bond Count
3
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