Cycloheptylamine (HCID 2899)

Names & identifiers

Preferred name: Cycloheptylamine
IUPAC: cycloheptanamine
English name: CYCLOHEPTYLAMINE
Molecular formula: C7H15N
Molecular weight: 113.2

Names & synonyms

CycloheptylamineCycloheptanamine5452-35-794Y6LRJ7TCNSC-18962DTXSID7063899RefChem:580317DTXCID4041735226-693-1AminocycloheptaneMFCD00004153cycloheptyl amine

Show more names

cycoheptylamineAKOS BBS-000035951-CycloheptanamineTIMTEC-BB SBB004311Cycloheptylamine,99%(2-Cycloheptyl)amine

Cycloheptanamine-N-cycloheptylamine1-cycloheptylaminecycloheptanyl amineSZ1EINECS 226-693-1NSC 18962Cycloheptylamine, 99%

Database identifiers

CAS: 5452-35-7
PubChem CID: 2899
DTXSID: DTXSID7063899
ChEMBL: CHEMBL1171864
UNII: 94Y6LRJ7TC
EC Number: 226-693-1
Nikkaji: J217H

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 8
Formal charge: 0
Complexity: 53

Experimental & physicochemical properties

Kovats Retention Index987.3

Physicochemical properties

Melting point: -18 °C · -18°C
Boiling point: 54 °C/11 · 54 °C/11 mmHg (lit.)
Density: 0.889 g/mL · 0.889 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.472(lit.)
Flash point: 108 °F · 108 °F
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
form: Liquid
pka: 11.04 · 11.04±0.20(Predicted)
color: Clear colorless to slightly yellow
Specific Gravity: 0.887 · 0.887
BRN: 1847543 · 1847543
InChI: InChI=1S/C7H15N/c8-7-5-3-1-2-4-6-7/h7H,1-6,8H2
InChIKey: VXVVUHQULXCUPF-UHFFFAOYSA-N
SMILES: C1(N)CCCCCC1
CAS DataBase Reference: 5452 · 5452-35-7(CAS DataBase Reference)
FDA UNII: 94 Y6LRJ7TC · 94Y6LRJ7TC
EPA Substance Registry System: Cycloheptanamine (5452-35-7)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 2 · GHS02,GHS07
Signal word: Warning
Hazard statements: 226 · H226-H315-H319-H335
Precautionary statements: 210 · P210-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi
Risk Statements: 10 · 10-37/38
Safety Statements: 23 · 23
RIDADR: 2734 · UN 2734 8/PG 2
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: 8 · 8
PackingGroup: II
HS Code: 29213099 · 29213099
Storage Class: 3 · 3 - Flammable liquids
Hazard Classifications: 2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
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 · 6 items

This chemical does not meet GHS hazard criteria for 2.2% (1 of 46) of reports.

Danger

H226 (97.8%): Flammable liquid and vapor [Warning Flammable liquids]；H314 (13%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (84.8%): Causes skin irritation [Warning Skin corrosion/irritation]；H335 (87%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P332+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 46 reports by companies.；There are 5 notifications provided by 45 of 46 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (97.8%)；Skin Corr. 1B (13%)；Skin Irrit. 2 (84.8%)；STOT SE 3 (87%)

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
ridadr: UN 2734 8/PG 2
hs_code: 29213099
risk_code: 10-37/38
Signal word: Warning
Symbol(GHS): GHS02,GHS07
hazard_code: Xi
safety_code: 23
hazard_class: 8
Storage Class: 3 - Flammable liquids
packing_group: II
target organs: Respiratory system
Hazard statements: H226-H315-H319-H335
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)
Hazard Classifications: Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Precautionary statements: P210-P302+P352-P305+P351+P338