CAS 33788-00-0 6-Aminoundecane (HCID 141845)

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Basic information

CAS: 33788-00-0
Standard SMILES: CCCCCC(N)CCCCC
InChIKey: GFBRYGJZWXLRFR-UHFFFAOYSA-N
Molecular formula: C11H25N
Average molar mass: 171.32 g/mol
Monoisotopic mass: 171.1986998

Names & identifiers

Preferred name: 6-Aminoundecane
IUPAC: undecan-6-amine
English name: 6-Aminoundecane
Molecular formula: C11H25N
Molecular weight: 171.32

Names & synonyms

6-Aminoundecane33788-00-01-Pentylhexylamine6-UndecylamineDTXSID80187449RefChem:104220DTXCID40109940GFBRYGJZWXLRFR-UHFFFAOYSA-Nundecan-6-amine6-Undecanamine6-amino undecaneMFCD00047924

Show more names

EA739NISTC33788000

undecan- 6- amineSCHEMBL672857BS-52905CS-0187827U0094EN300-128266T72322FT-0639130

Database identifiers

CAS: 33788-00-0
PubChem CID: 141845
DTXSID: DTXSID80187449
EC Number: 833-849-8
Nikkaji: J3.243.096A

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 8
Heavy atoms: 12
Formal charge: 0
Complexity: 71

Physicochemical properties

Boiling point: 158 °C/28mmHg · 158°C/28mmHg(lit.)
Density: 0.799 · 0.799±0.06 g/cm3(Predicted)
refractive index: 1.434 to · 1.4340 to 1.4380
storage temp.: 2 · 2-8°C, protect from light
pka: 11.13 · 11.13±0.35(Predicted)
form: clear liquid
color: Colorless to Almost colorless
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314-H227
Precautionary statements: 501 · P501-P210-P264-P280-P370+P378-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405
RIDADR: 2735 · UN 2735 8/PG II
HS Code: 2921.19 · 2921.19.6190
HazardClass: 8 · 8
PackingGroup: II

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Dam. 1 (100%)

Safety data

ridadr: UN 2735 8/PG II
hs_code: 2921.19.6190
Signal word: Danger
Symbol(GHS): GHS05
hazard_class: 8
packing_group: II
Hazard statements: H314-H227
Precautionary statements: P501-P210-P264-P280-P370+P378-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405