HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Benzylcyclopropane

HCID 74274
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1667-00-1
Standard SMILES
c1ccc(CC2CC2)cc1
InChIKey
GUGXBRGATQTAFP-UHFFFAOYSA-N
Molecular formula
C10H12
Average molar mass
132.2 g/mol
Monoisotopic mass
132.09390038

Names & identifiers

Preferred name
Benzylcyclopropane
IUPAC
cyclopropylmethylbenzene
English name
Cyclopropylphenylmethane
Molecular formula
C10H12
Molecular weight
132.2

Names & synonyms

(Cyclopropylmethyl)benzene1667-00-1BenzylcyclopropaneEINECS 216-782-3DTXSID60168155RefChem:566942DTXCID3090646216-782-3CyclopropylphenylmethaneBenzene, (cyclopropylmethyl)-CyclopropylmethylbenzeneMFCD00019257
Show more names
α-cyclopropyltolueneCYCLOPROPYLPHENYLMETHANE,99%CYCLOPROPYLPHENYLMETHANE ISO 9001:2015 REACH
Benzene,(cyclopropylmethyl)-cyclopropane,benzyl-alpha-cyclopropyltolueneCyclopropyl phenylmethanemethane,cyclopropylphenyl-LX9U4V2RJW(Cyclopropylmethyl)benzene #SCHEMBL674275

Database identifiers

CAS
1667-00-1
PubChem CID
74274
DTXSID
DTXSID60168155
UNII
LX9U4V2RJW
EC Number
216-782-3
Nikkaji
J195.306K

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
96.6

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Aromatic Hydrocarbons
SpringerMaterials PropertiesDensity
Physical DescriptionClear colorless liquid; [Acros Organics MSDS]

Physicochemical properties

Melting point
4.8 °C · 4.8°C
Boiling point
179.15 °C · 179.15°C (rough estimate)
Density
0.9059 · 0.9059 (estimate)
refractive index
1.5131 · 1.5131-1.5151
Flash point
62 °C · 62 °C
FDA UNII
9 U4V2RJW · LX9U4V2RJW
Symbol(GHS)
2 · GHS02,GHS07,GHS08
Signal word
Danger
Hazard statements
319 · H319-H335-H226-H315-H304-H412
Precautionary statements

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 · 4 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P331, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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

Hazards SummaryMay cause irritation; [Acros Organics MSDS] See Ethylcyclopropane.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS02,GHS07,GHS08
safety_code
24/25
Hazard statements
H319-H335-H226-H315-H304-H412
Precautionary statements
P273-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Upstream & downstream products

Downstream products

Cyclopropyl phenyl ketone

Suppliers13 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
上海康恩博医药科技有限公司(科小研试剂)400-1388-521 17510465506 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
上海锋基医药科技有限公司15555063509 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]

Related reactions

2 records
New reaction record
HRID 1225026 reaction equation
HRID 1225026As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1741830 reaction equation
HRID 1741830As reactantuspto-grants-1994_08

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
273 · P273-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Safety Statements
24 · 24/25
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]