Basic information
- CAS
1862-07-3- Standard SMILES
CN(C)CCCCCCO- InChIKey
QCXNXRUTKSIZND-UHFFFAOYSA-N- Molecular formula
- C8H19NO
- Average molar mass
- 145.24 g/mol
- Monoisotopic mass
- 145.14666423
Names & identifiers
- Preferred name
- 6-Dimethylaminohexan-1-ol
- IUPAC
- 6-(dimethylamino)hexan-1-ol
- English name
- 6-Dimethylamino-1-hexanol
- Molecular formula
- C8H19NO
- Molecular weight
- 145.24
Names & synonyms
Show more names
Database identifiers
- CAS
1862-07-3- PubChem CID
- 74623
- DTXSID
DTXSID3062023- EC Number
- 404-680-3、638-811-2
- Nikkaji
- J124.892H
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 64.3
Physicochemical properties
- Boiling point
- 117 °C · 117 °C / 12mmHg
- Density
- 0 · 0,88 g/cm3
- refractive index
- 1.446 · 1.4460-1.4500
- storage temp.
- Refrigerator
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Oil
- pka
- 15.19 · 15.19±0.10(Predicted)
- color
- Colourless Liquid
- InChI
- InChI=1S/C8H19NO/c1-9(2)7-5-3-4-6-8-10/h10H,3-8H2,1-2H3
- InChIKey
- QCXNXRUTKSIZND-UHFFFAOYSA-N
- SMILES
- C(O)CCCCCN(C)C
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 1 · 1-Hexanol, 6-(dimethylamino)- (1862-07-3)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314-H412
- Precautionary statements
- 260 · P260-P264-P270-P273-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
- Hazard Codes
- C
- Risk Statements
- 10 · 10-20/21/22-34-52/53-22
- Safety Statements
- 16 · 16-26-36/37/39-45-61
- RIDADR
- 2733 · 2733
- TSCA
- TSCA listed
- HS Code
- 2922.19 · 2922.19.7000
- HazardClass
- 8 · 8
- PackingGroup
- II
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Danger
H302 (95.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/8471
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute Tox. 4 (95.7%)
Acute toxicity - category 4
Acute Tox. 4 *
Safety data
- tsca
- TSCA listed
- ridadr
- 2733
- hs_code
- 2922.19.7000
- risk_code
- 10-20/21/22-34-52/53-22
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- C
- safety_code
- 16-26-36/37/39-45-61
- hazard_class
- 8
- packing_group
- II
- Hazard statements
- H302-H314-H412
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Precautionary statements
- P260-P264-P270-P273-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Chemistry & industry
Uses & manufacturing
Applications
UsesAn alkanolamine as lysosomotropic agent and choline uptake inhibitor.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers66 total
Related reactions
Compound notes
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