(S)-2-Aminohexane
Basic information
- CAS
70492-67-0- Standard SMILES
CCCC[C@H](C)N- InChIKey
WGBBUURBHXLGFM-LURJTMIESA-N- Molecular formula
- C6H15N
- Average molar mass
- 101.19 g/mol
- Monoisotopic mass
- 101.12044948
Names & identifiers
- Preferred name
- (S)-2-Aminohexane
- IUPAC
- (2S)-hexan-2-amine
- English name
- (S)-2-Aminohexane
- Molecular formula
- C6H15N
- Molecular weight
- 101.19
Names & synonyms
(S)-2-AminohexaneDTXSID50426453RefChem:1051152DTXCID80377287(2S)-hexan-2-amine70492-67-0MFCD00671626(S)-(+)-2-AMINOHEXANE(2S)-Hexylamine(+)-(s)-2-aminohexaneSCHEMBL353779SCHEMBL6122041
Show more names
(S)-2-HEXYLAMINE(S)-2-HEXANAMINE(2S)-2-hexanamine2-Hexanamine, (2S)-(2R)-Hexylamine~(R)-1-Methylpentylamine(S)-(+)-2-AMINOHEXANE: CHIPROS 99%, EE 99%(S)-(+)-2-Aminohexane, ChiPros 99+%, ee 99+%
SCHEMBL18992977(S)-2-Aminohexane, >=97.0%AKOS006349673AKOS015840327SY383012DB-074309EN300-1836238(S)-2-Aminohexane, ChiPros(R), produced by BASF, 99%
Database identifiers
- CAS
70492-67-0- PubChem CID
- 6999846
- DTXSID
DTXSID50426453- EC Number
- 622-789-6
- Nikkaji
- J1.438.026D
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 35.2
Physicochemical properties
- Melting point
- -20 °C · <-20°C
- Boiling point
- 116 °C · 116°C
- Density
- 0 · 0,755 g/cm3
- Flash point
- -3 °C · -3°C
- pka
- 11.04 · 11.04±0.35(Predicted)
- form
- liquid
- color
- Clear, colourless
- Water Solubility
- Soluble in water (17g/L at 20°C)
- Sensitive
- Air Sensitive
- BRN
- 5237601 · 5237601
- CAS DataBase Reference
- 70492 · 70492-67-0(CAS DataBase Reference)
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 312 · H312-H318-H332-H225-H302-H314
- Precautionary statements
- 210 · P210-P280-P305+P351+P338-P310-P309
- Hazard Codes
- C,F
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 147 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- F
- 10-34
- wgk
- 3
- ridadr
- UN 2735 8/PG 2
- hs_code
- 2921199990
- risk_code
- 22-34-11
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07
- hazard_code
- C,F
- safety_code
- 26-36/37/39-45
- hazard_class
- 3
- packing_group
- II
- Hazard statements
- H312-H318-H332-H225-H302-H314
- Precautionary statements
- P210-P280-P305+P351+P338-P310-P309
Chemistry & industry
Applications
Uses(S)-(+)-2-Aminohexane is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields.
Suppliers
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Related reactions
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Compound notes
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