2-[(1R,2R)-1,2-diamino-2-(2-hydroxyphenyl)ethyl]phenol

2-[(1R,2R)-1,2-diamino-2-(2-hydroxyphenyl)ethyl]phenol

CAS: 870991-70-1

Formula: C14H16N2O2

SMILES: N[C@@H]([C@H](N)C1=CC=CC=C1O)C1=CC=CC=C1O

IUPAC: 2-[(1R,2R)-1,2-diamino-2-(2-hydroxyphenyl)ethyl]phenol

InChI: 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

Composition: C (68.83%), H (6.60%), N (11.47%), O (13.10%)

Molar Mass: 244.294

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	244.121177763
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
InChIKey	MRNPLGLZBUDMRE-ZIAGYGMSSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.4
Topological Polar Surface Area	92.5
Polarizability	27.87
Ring Count	2
Rotatable Bond Count	3

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