90999-87-4 Purity
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Specification
The molecular formula of CHEMBRDG-BB 5731127 is C9H10BrClO.
CHEMBRDG-BB 5731127 was created on May 28, 2009.
The computed IUPAC name of CHEMBRDG-BB 5731127 is 2-(2-bromoethoxy)-1-chloro-4-methylbenzene.
The InChIKey of CHEMBRDG-BB 5731127 is DGTRQYPWARXPLQ-UHFFFAOYSA-N.
The XLogP3 value of CHEMBRDG-BB 5731127 is 3.6.
There is 1 hydrogen bond acceptor in CHEMBRDG-BB 5731127.
The topological polar surface area of CHEMBRDG-BB 5731127 is 9.2 Ų.
There are 12 heavy atoms in the structure of CHEMBRDG-BB 5731127.
Yes, CHEMBRDG-BB 5731127 is a canonicalized compound.
CHEMBRDG-BB 5731127 has 3 rotatable bond counts.