azepane-4-carboxylic acid hydrochloride

azepane-4-carboxylic acid hydrochloride

CAS: 1393449-23-4

Formula: C7H14ClNO2

SMILES: Cl.OC(=O)C1CCCNCC1

IUPAC: azepane-4-carboxylic acid hydrochloride

InChI: InChI=1/C7H13NO2.ClH/c9-7(10)6-2-1-4-8-5-3-6;/h6,8H,1-5H2,(H,9,10);1H

Composition: C (46.80%), H (7.86%), Cl (19.73%), N (7.80%), O (17.81%)

Molar Mass: 179.64

Atom Count: 25

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	179.0713064
Formal Charge	0
FSP3	0.86
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	FFWLYUUJGYMITQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.68
Topological Polar Surface Area	49.33
Polarizability	14.95
Ring Count	1
Rotatable Bond Count	1

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95%	<5 Days	1393449-23-4		$103.40-$430.00$103.40$165.19$430.00