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Home > Boronic Acids > 2096334-18-6
2096334-18-6 | 1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate
CAS No: 2096334-18-6 Catalog No: AG01EHEV MDL No:MFCD22205765
Product Description
Catalog Number:
AG01EHEV
Chemical Name:
1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate
CAS Number:
2096334-18-6
MDL Number:
MFCD22205765
IUPAC Name:
[2-(cyclopropylmethyl)pyrazol-3-yl]boronic acid;dihydrate
InChI:
InChI=1S/C7H11BN2O2.2H2O/c11-8(12)7-3-4-9-10(7)5-6-1-2-6;;/h3-4,6,11-12H,1-2,5H2;2*1H2
InChI Key:
JYFMKTBMMXKIEE-UHFFFAOYSA-N
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
202.017g/mol
Monoisotopic Mass:
202.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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