4-bromo-1H-indole-3-carbonitrile

4-bromo-1H-indole-3-carbonitrile

CAS: 903131-13-5

Formula: C9H5BrN2

SMILES: BrC1=C2C(NC=C2C#N)=CC=C1

IUPAC: 4-bromo-1H-indole-3-carbonitrile

InChI: InChI=1S/C9H5BrN2/c10-7-2-1-3-8-9(7)6(4-11)5-12-8/h1-3,5,12H

Composition: C (48.90%), H (2.28%), Br (36.15%), N (12.67%)

Molar Mass: 221.057

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	219.963611
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PMIGAISGWPTELT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.49
Topological Polar Surface Area	39.58
Polarizability	20.07
Ring Count	2
Rotatable Bond Count	0

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	903131-13-5		$47.61-$656.19$47.61$64.17$217.35$431.60$656.19

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	903131-13-5		$1,570.00-$2,750.00$1,570.00$1,860.00$2,750.00