1-pentanol, 4-amino

Compound Structure:

Synonyms:

4-Amino-4-methylpentan-1-ol;1-Pentanol, 4-amino-4-methyl-;4-amino-4-methyl-1-pentanol;4-Amino-4-methyl-pentan-1-ol;SCHEMBL1409321;1-Pentanol,4-amino-4-methyl-

Compound ID:

NMPC-116

PubChem ID:

13107682

Molecular Formula:

C6H15NO

Canonical SMILES:

CC(C)(CCCO)N

InChIKey:

PUCFHKBOPVGLPI-UHFFFAOYSA-N

About the compound:

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	117.19 g/mol
XLogP3-AA	-0.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	117.115364102 g/mol
Monoisotopic Mass	117.115364102 g/mol
Topological Polar Surface Area	46.2Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	61.5
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Rauvolfia vomitoria

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