CAS 2508-29-4 5-Aminopentan-1-ol (HCID 75634)

Names & identifiers

Preferred name: 5-Aminopentan-1-ol
IUPAC: 5-aminopentan-1-ol
English name: 5-Amino-1-pentanol
Molecular formula: C5H13NO
Molecular weight: 103.16

Names & synonyms

5-Amino-1-pentanol5-Aminopentan-1-ol2508-29-4EINECS 219-718-2LQGKDMHENBFVRC-UHFFFAOYSA-DTXSID101797715Amino1pentanolRefChem:532445DTXCID70102262219-718-2InChI=1/C5H13NO/c6-4-2-1-3-5-7/h7H,1-6H21-Pentanol, 5-amino-

Show more names

NH2-PEN-OHH-APE(5)-OLPentanolamineNH2-(CH2)5-OHAminopentanol5-Amino-1-pen5-PENTANOLAMINE5-aminopentylol

MFCD00008237Pentanol, 5-amino-5-Amino-pentan-1-ol5-aminopentanolTolmetin ?-D-Glucuronidepentane, 1-amino-5-hydroxy-5-AMINO-1-PENTANOL, 50% in Water5-amino pentanol

Database identifiers

CAS: 2508-29-4
PubChem CID: 75634
DTXSID: DTXSID10179771
ChEMBL: CHEMBL333552
EC Number: 219-718-2
Nikkaji: J47.665J

Properties

Computed structural properties

XLogP: -0.3
Topological polar surface area: 46.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 7
Formal charge: 0
Complexity: 31.3

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Amino Alcohols, Other

SpringerMaterials PropertiesOptical coefficient

Physical DescriptionWhite or pale yellow solid; mp = 34-37 deg C; [Alfa Aesar MSDS]

Physicochemical properties

Melting point: 33 · 33-35 °C (lit.)
Boiling point: 120 · 120-122 °C/16 mmHg (lit.)
Density: 0.949 g/mL · 0.949 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.4615(lit.)
Flash point: 150 °F · 150 °F
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: Chloroform, Ethyl Acetate
form: Oil
pka: 15.16 · 15.16±0.10(Predicted)
color: Yellow
PH: 13.2 · 13.2 (500g/l, H2O, 20℃)
Water Solubility: miscible
Sensitive: Air Sensitive
BRN: 1732302 · 1732302
InChI: 1S/C5H13NO/c6-4-2-1-3-5-7/h7H,1-6H2
InChIKey: LQGKDMHENBFVRC-UHFFFAOYSA-N
SMILES: NCCCCCO
CAS DataBase Reference: 2508 · 2508-29-4(CAS DataBase Reference)
NIST Chemistry Reference: 5 · Pentanol, 5-amino-(2508-29-4)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
PPE: 3 · Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
Hazard Codes: C
Risk Statements: 22 · 22-34-35
Safety Statements: 26 · 26-36/37/39-45
RIDADR: 3259 · UN 3259 8/PG 3
WGK Germany: 2 · 2
F: 10 · 10-34
Hazard Note: Irritant
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29221980 · 29221980
Storage Class: 8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications: 4 OralSkin · Acute Tox. 4 OralSkin Corr. 1B
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 0.7% (1 of 152) of reports.

Danger

H302 (98.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 152 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 4 (98.7%)

Toxicology

Adverse EffectsDermatotoxin - Skin burns.

Safety data

F: 10-34
PPE: Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
wgk: 2
ridadr: UN 3259 8/PG 3
hs_code: 29221980
risk_code: 22-34-35
Signal word: Danger
Symbol(GHS): GHS05,GHS07
hazard_code: C
hazard_note: Irritant
safety_code: 26-36/37/39-45
hazard_class: 8
Storage Class: 8A - Combustible corrosive hazardous materials
packing_group: III
Hazard statements: H302-H314
Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications: Acute Tox. 4 OralSkin Corr. 1B
Precautionary statements: P280-P305+P351+P338-P310

Chemistry & industry

Applications · 4 items

Description5-Amino-1-pentanol is a linker containing a hydroxyl group and amine group. The hydroxyl group enables further derivatization or replacement with other reactive functional groups. The amine group is reactive with carboxylic acids, activated NHS esters, carbonyls (ketone, aldehyde) etc.

Uses5-Amino-1-pentanol is an aliphatic amino alcohol with potential plasma lipid-lowering properties. 5-Amino-1-pentanol and other amino alcohols are used as emulsifying agents in dry-cleaning soaps, wax removers, cosmetics, paints and insecticides.

Uses5-Amino-1-pentanol has been used in the synthesis of S-glycosyl amino-acid building blocks. It has been used as starting reagent in the synthesis of aminofunctionalized 4-chloro-2,2′:6′,2′′-terpyridine.

General Description5-Amino-1-pentanol undergoes facile intramolecular cyclocondensation with piperidine and methyl or ethyl piperidine in the presence of methanol or ethanol over zeolite catalyst.