(R)-BoroLeu-(+)-Pinanediol trifluoroacetate, 0%

Name: (R)-BoroLeu-(+)-Pinanediol trifluoroacetate
Brand: Chempure

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CAS Number

179324-87-9

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About this item

IUPAC name	(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butan-1-amine;2,2,2-trifluoroacetic acid
inchi	InChI=1S/C15H28BNO2.C2HF3O2/c1-9(2)6-13(17)16-18-12-8-10-7-11(14(10,3)4)15(12,5)19-16;3-2(4,5)1(6)7/h9-13H,6-8,17H2,1-5H3;(H,6,7)/t10-,11-,12+,13-,15-;/m0./s1
inchi key	SRFQKJZNJYTMNI-CDVUYJLHSA-N
molecular formula	C17H29BF3NO4
synonyms	179324-87-9 (R)-BoroLeu-(+)-Pinanediol trifluoroacetate (R)-BoroLeu-(+)-Pinanediol-CF3COOH (R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester trifluoroacetate 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-, (alphaR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)

Computed Properties

Molecular Weight:	379.2 g/mol
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	8
Rotatable Bond Count:	3
Exact Mass:	379.2141731 g/mol
Monoisotopic Mass:	379.2141731 g/mol
Topological Polar Surface Area:	81.8 Å²
Heavy Atom Count:	26
Formal Charge:	0
Complexity:	457
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	5
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	2
Compound Is Canonicalized:	Yes

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Product No: BO1381

(R)-BoroLeu-(+)-Pinanediol trifluoroacetate, 0%

Product No: BO1381

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