tert-butyl N-(7-hydroxyheptyl)-N-methylcarbamate

tert-butyl N-(7-hydroxyheptyl)-N-methylcarbamate

CAS: 2169111-47-9

Formula: C13H27NO3

SMILES: CN(CCCCCCCO)C(=O)OC(C)(C)C

IUPAC: tert-butyl N-(7-hydroxyheptyl)-N-methylcarbamate

InChI: InChI=1S/C13H27NO3/c1-13(2,3)17-12(16)14(4)10-8-6-5-7-9-11-15/h15H,5-11H2,1-4H3

Composition: C (63.64%), H (11.09%), N (5.71%), O (19.56%)

Molar Mass: 245.363

Atom Count: 44

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	245.199093733
Formal Charge	0
FSP3	0.92
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PMQJYJHGPFXULP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.29
Topological Polar Surface Area	49.77
Polarizability	27.2
Ring Count	0
Rotatable Bond Count	9

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97%	<7 Days	2169111-47-9		$240.96-$551.04$240.96$361.92$551.04