2,2'-((1R,2R)-1,2-Diaminoethane-1,2-diyl)diphenol

Catalog Number	ACM870991701-2
CAS	870991-70-1
Structure
Synonyms	(1R,2R)-1,2-Bis(2-hydroxyphenyl)ethylenediamine
IUPAC Name	2-[(1R,2R)-1,2-diamino-2-(2-hydroxyphenyl)ethyl]phenol
Molecular Weight	244.29
Molecular Formula	C14H16N2O2
Canonical SMILES	C1=CC=C(C(=C1)C(C(C2=CC=CC=C2O)N)N)O
InChI	MRNPLGLZBUDMRE-ZIAGYGMSSA-N
InChI Key	InChI=1S/C14H16N2O2/c15-13(9-5-1-3-7-11(9)17)14(16)10-6-2-4-8-12(10)18/h1-8,13-14,17-18H,15-16H2/t13-,14-/m1/s1
Boiling Point	457.9±40.0 °C(Predicted)
Melting Point	157-163 °C
Purity	98%+
Appearance	White to off-white powder
Exact Mass	244.121177757
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
Isomeric SMILES	C1=CC=C(C(=C1)[C@H]([C@@H](C2=CC=CC=C2O)N)N)O
Monoisotopic Mass	244.121177757
Rotatable Bond Count	3
Topological Polar Surface Area	92.5 Ų