5-Chloroquinolin-6-amine

CAT: 0127-OR1053680-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1053680-01Size:50 mg

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CAS Number

778516-03-3

MDL Number

MFCD20694928

Purity

95%

Smiles

NC1=CC=C2N=CC=CC2=C1Cl

Chemical Information

5-Chloroquinolin-6-amine

CAS Number	778516-03-3
PubChem CID	21430518
IUPAC Name	5-chloroquinolin-6-amine
Molecular Formula	C9H7ClN2
Molecular Weight	178.62
XLogP	2.1
Topological Polar Surface Area	38.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	163

SMILES

C1=CC2=C(C=CC(=C2Cl)N)N=C1

InChI

InChI=1S/C9H7ClN2/c10-9-6-2-1-5-12-8(6)4-3-7(9)11/h1-5H,11H2

InChIKey

WTRMRECJKJDLBA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 778516-03-3

CID: 21430518

Formula: C9H7ClN2

MW: 178.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	178.62
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	178.0297759
Monoisotopic Mass	178.0297759
Topological Polar Surface Area	38.9 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	163
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
JH36679	3-chloroquinolin-6-amine
KTB19291-01	4-Chloroquinolin-6-amine
YJB96981-01	3-chloroquinolin-5-amine
sc-278181A	5-chloroquinolin-8-amine
TCA05037-01	5-Chloroquinolin-2-amine
HZA37799-01	2-chloroquinolin-5-amine
sc-351607A	8-chloroquinolin-5-amine hydrochloride
LZB16217-01	6-Chloroquinolin-5-ol
HY-W039481-01	6-Bromo-2-chloroquinolin-4-amine
ZZB38096-01	6-Bromo-8-chloroquinolin-4-amine