AG00367D

1041642-14-1 | POTASSIUM TRANS-2-METHYLCYCLOHEXYLTRIFLUOROBORATE

AG00367D

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CAS Number	1041642-14-1
Catalog Number	AG00367D(AGN-PC-0WAM0G)
Chemical Name	POTASSIUM TRANS-2-METHYLCYCLOHEXYLTRIFLUOROBORATE
IUPAC Name	potassium;trifluoro-[(1R,2R)-2-methylcyclohexyl]boranuide
InChI	InChI=1S/C7H13BF3.K/c1-6-4-2-3-5-7(6)8(9,10)11;/h6-7H,2-5H2,1H3;/q-1;+1/t6-,7-;/m1./s1
InChI Key	RAVXMQPYEBSTJX-ZJLYAJKPSA-N
MDL Number	MFCD28955335
Molecular Formula	C7H13BF3K
Molecular Weight	204.0826
SMILES	[B+3]([F-])([F-])([F-])[CH-]1[C@H](C)CCCC1.[K+]
Synonyms	POTASSIUM TRANS-2-METHYLCYCLOHEXYLTRIFLUOROBORATE, 1041642-14-1, DTXSID90678459, MFCD28955335, CS-0046251, C-2254, Potassium rel-trifluoro((1R,2R)-2-methylcyclohexyl)borate, Potassium trifluoro[(1R,2R)-2-methylcyclohexyl]borate(1-),

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	204.07g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	204.085g/mol
Monoisotopic Mass	204.07g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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