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Home > Boronic Acids > 17745-45-8
17745-45-8 | Boronic acid, B-propyl-
CAS No: 17745-45-8 Catalog No: AG0025C6 MDL No:MFCD01074564
Product Description
Catalog Number:
AG0025C6
Chemical Name:
Boronic acid, B-propyl-
CAS Number:
17745-45-8
Molecular Formula:
C3H9BO2
Molecular Weight:
87.9134
MDL Number:
MFCD01074564
IUPAC Name:
propylboronic acid
InChI:
InChI=1S/C3H9BO2/c1-2-3-4(5)6/h5-6H,2-3H2,1H3
InChI Key:
JAQOMSTTXPGKTN-UHFFFAOYSA-N
SMILES:
CCCB(O)O
NSC Number:
518339
Properties
Complexity:
30
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
88.07g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
87.913g/mol
Monoisotopic Mass:
88.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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