CAS 20017-68-9 1,1'-(3-Bromopropylidene)bisbenzene (HCID 88333)

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Basic information

CAS: 20017-68-9
Standard SMILES: BrCCC(c1ccccc1)c1ccccc1
InChIKey: SLHSRCBFPHCSGL-UHFFFAOYSA-N
Molecular formula: C15H15Br
Average molar mass: 275.18 g/mol
Monoisotopic mass: 274.03571258

Names & identifiers

Preferred name: 1,1'-(3-Bromopropylidene)bisbenzene
IUPAC: (3-bromo-1-phenylpropyl)benzene
English name: 1-BROMO-3,3-DIPHENYLPROPANE
Molecular formula: C15H15Br
Molecular weight: 275.18

Names & synonyms

1,1'-(3-Bromopropylidene)bisbenzeneDTXSID30173832EINECS 243-467-8NSC 72996RefChem:409059DTXCID3096323243-467-820017-68-91-Bromo-3,3-diphenylpropane(3-Bromopropane-1,1-diyl)dibenzene(3-bromo-1-phenylpropyl)benzene3,3-Diphenylpropyl Bromide

Show more names

BroMo-3,3-diphenylpropanLercanidipine Impurity 221,1-Diphenyl-3-bromopropane3,3-diphenyl-1-bromopropane3,3-DiphenylpropylBromide>(3-BROMO-1-PHENYLPROPYL)BENZENE(1-Phenyl-3-bromopropyl)benzene

benzene, 1,1'-(3-bromopropylidene)bis-3-Bromo-1,1-diphenylpropaneMFCD00044829Lercanidipine Impurity 6NSC72996AS-36621EN300-1869574AN-584/43345393

Database identifiers

CAS: 20017-68-9
PubChem CID: 88333
DTXSID: DTXSID30173832
EC Number: 243-467-8
Nikkaji: J23.154A

Properties

Computed structural properties

XLogP: 4.8
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 160

Physicochemical properties

Melting point: 39 · 39-42 °C
Boiling point: 145 °C · 145°C 2mm
Density: 1.3288 · 1.3288 (rough estimate)
refractive index: 1.6822 · 1.6822 (estimate)
storage temp.: 2 · Sealed in dry,2-8°C
solubility: soluble in Methanol
form: Crystalline Powder
color: White to off-white
CAS DataBase Reference: 20017 · 20017-68-9(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Hazard Codes: C
Risk Statements: 34 · 34
Safety Statements

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P332+P317, P337+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (50%)

Safety data

ridadr: UN3261
hs_code: 29033919
risk_code: 34
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: C
safety_code: 45-36/37/39-26
hazard_class: 8
packing_group: III
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313