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5-bromoquinazolin-4-amine

5-bromoquinazolin-4-amine

CAS: 1201784-87-3

Formula: C8H6BrN3

SMILES: NC1=C2C(Br)=CC=CC2=NC=N1

IUPAC: 5-bromoquinazolin-4-amine

InChI: InChI=1S/C8H6BrN3/c9-5-2-1-3-6-7(5)8(10)12-4-11-6/h1-4H,(H2,10,11,12)

Composition: C (42.88%), H (2.70%), Br (35.66%), N (18.75%)

Molar Mass: 224.061

Atom Count: 18

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 222.97451
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey VMJYEOHNMHOAHL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.44
Topological Polar Surface Area 51.8
Polarizability 19.92
Ring Count 2
Rotatable Bond Count 0

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