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16876-23-6 | Boronic acid, (iodomethyl)- (9CI)
CAS No: 16876-23-6 Catalog No: AG001Y9G MDL No:
Product Description
Catalog Number:
AG001Y9G
Chemical Name:
Boronic acid, (iodomethyl)- (9CI)
CAS Number:
16876-23-6
Molecular Formula:
CH4BIO2
Molecular Weight:
185.7567
IUPAC Name:
iodomethylboronic acid
InChI:
InChI=1S/CH4BIO2/c3-1-2(4)5/h4-5H,1H2
InChI Key:
WTHUADGVVQZUMW-UHFFFAOYSA-N
SMILES:
ICB(O)O
NSC Number:
101517
Properties
Complexity:
23.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.935g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.755g/mol
Monoisotopic Mass:
185.935g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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