CID 19827425
PubChem CID
19827425
Structure
Molecular Formula
Status
Non-live
Molecular Weight
210.10 g/mol
Dates
- Create:2007-12-05
Chemical Structure Depiction
1-(2-aminophenyl)ethanol;dihydrochloride
InChI=1S/C8H11NO.2ClH/c1-6(10)7-4-2-3-5-8(7)9;;/h2-6,10H,9H2,1H3;2*1H
YTBVQJXXDIPZGT-UHFFFAOYSA-N
CC(C1=CC=CC=C1N)O.Cl.Cl
C8H13Cl2NO
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
210.10 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
4
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
1
Property Name
Exact Mass
Property Value
209.0374194 g/mol
Property Name
Monoisotopic Mass
Property Value
209.0374194 g/mol
Property Name
Topological Polar Surface Area
Property Value
46.3 A^2
Property Name
Heavy Atom Count
Property Value
12
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
105
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
1
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
3
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS