Home Other Building Blocks (2S)-2-Hydroxybutanedioic acid compd. with (alphaR)-N,alpha-dimethyl-3,5-bis(trifluoromethyl)benzenemethanamine

(2S)-2-Hydroxybutanedioic acid compd. with (alphaR)-N,alpha-dimethyl-3,5-bis(trifluoromethyl)benzenemethanamine

CAS No.:
935534-56-8
Catalog Number:
AG00H2TZ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00H2TZ
Chemical Name:
(2S)-2-Hydroxybutanedioic acid compd. with (alphaR)-N,alpha-dimethyl-3,5-bis(trifluoromethyl)benzenemethanamine
CAS Number:
935534-56-8
MDL Number:
MFCD26940220
IUPAC Name:
(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine;(2S)-2-hydroxybutanedioic acid
InChI:
InChI=1S/C11H11F6N.C4H6O5/c1-6(18-2)7-3-8(10(12,13)14)5-9(4-7)11(15,16)17;5-2(4(8)9)1-3(6)7/h3-6,18H,1-2H3;2,5H,1H2,(H,6,7)(H,8,9)/t6-;2-/m00/s1
InChI Key:
HBPYTBKIFYFGLU-FMEGDIDESA-N
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
405.101g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
405.293g/mol
Monoisotopic Mass:
405.101g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties