CAS
958451-90-6 Purity
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958451-90-6 Purity
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4-(2-Fluoro-ethylsulfanyl)-benzeneboronic acid
CAS
958451-96-2
Catalog Number
ACM958451962
Category
Other Products
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Specification
Synonyms
4-(2-Fluoro-ethylsulfanyl)-benzeneboronic acid
What is the IUPAC name of the compound?
[4-(2-fluoroethylsulfanyl)phenyl]boronic acid
What is the InChI of the compound?
InChI=1S/C8H10BFO2S/c10-5-6-13-8-3-1-7(2-4-8)9(11)12/h1-4,11-12H,5-6H2
What is the InChIKey of the compound?
NGQNTMDWZJCFIU-UHFFFAOYSA-N
What is the canonical SMILES of the compound?
B(C1=CC=C(C=C1)SCCF)(O)O
What is the molecular weight of the compound?
200.04 g/mol
How many hydrogen bond donor counts are there in the compound?
2
How many hydrogen bond acceptor counts are there in the compound?
4
How many rotatable bond counts are there in the compound?
4
What is the exact mass of the compound?
200.0478591 g/mol
Is the compound canonicalized?
Yes
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