4-bromobicyclo[2.2.1]heptane-1-carboxylic acid

4-bromobicyclo[2.2.1]heptane-1-carboxylic acid

CAS: 15448-85-8

Formula: C8H11BrO2

SMILES: OC(=O)C12CCC(Br)(CC1)C2

IUPAC: 4-bromobicyclo[2.2.1]heptane-1-carboxylic acid

InChI: InChI=1S/C8H11BrO2/c9-8-3-1-7(5-8,2-4-8)6(10)11/h1-5H2,(H,10,11)

Composition: C (43.86%), H (5.06%), Br (36.47%), O (14.61%)

Molar Mass: 219.078

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	217.994243
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DKZHMCMRZOJEHS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.21
Topological Polar Surface Area	37.3
Polarizability	17.42
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	15448-85-8		$259.77-$3,211.77$259.77$416.13$714.99$1,070.59$3,211.77