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2-(aminomethyl)-4,6-dichlorophenol

2-(aminomethyl)-4,6-dichlorophenol

CAS: 38060-64-9

Formula: C7H7Cl2NO

SMILES: NCC1=C(O)C(Cl)=CC(Cl)=C1

IUPAC: 2-(aminomethyl)-4,6-dichlorophenol

InChI: InChI=1S/C7H7Cl2NO/c8-5-1-4(3-10)7(11)6(9)2-5/h1-2,11H,3,10H2

Composition: C (43.78%), H (3.67%), Cl (36.92%), N (7.29%), O (8.33%)

Molar Mass: 192.04

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 190.9904692
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey JTVDZUWMDWGQSB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.12
Topological Polar Surface Area 46.25
Polarizability 18.1
Ring Count 1
Rotatable Bond Count 1

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95% <5 Days 38060-64-9 $2,640.00-$4,306.00$2,640.00$4,306.00
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