(1R,2S)-2-{N'-[2-(4-bromophenoxy)acetyl]hydrazinecarbonyl}cyclohexane-1-carboxylic acid

(1R,2S)-2-{N'-[2-(4-bromophenoxy)acetyl]hydrazinecarbonyl}cyclohexane-1-carboxylic acid

Formula: C16H19BrN2O5

SMILES: OC(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)COC1=CC=C(Br)C=C1

IUPAC: (1R,2S)-2-{N'-[2-(4-bromophenoxy)acetyl]hydrazinecarbonyl}cyclohexane-1-carboxylic acid

InChI: InChI=1S/C16H19BrN2O5/c17-10-5-7-11(8-6-10)24-9-14(20)18-19-15(21)12-3-1-2-4-13(12)16(22)23/h5-8,12-13H,1-4,9H2,(H,18,20)(H,19,21)(H,22,23)/t12-,13+/m0/s1

Composition: C (48.14%), H (4.80%), Br (20.01%), N (7.02%), O (20.04%)

Molar Mass: 399.241

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	398.047735
Formal Charge	0
FSP3	0.44
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	DBQXLFXCLOGWLZ-QWHCGFSZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.36
Topological Polar Surface Area	104.73
Polarizability	34.63
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H19BrN2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00