Allene

HCID 10037

Basic information

CAS
12075-35-3
Standard SMILES
C=C=C
InChIKey
IYABWNGZIDDRAK-UHFFFAOYSA-N
Molecular formula
C3H4
Average molar mass
40.06 g/mol
Monoisotopic mass
40.03130013

Overview

Propadiene, stabilized appears as a colorless flammable gas. May become unstable. Not toxic but asphyxiation may occur because of displacement of oxygen. Under prolonged exposure to fire or heat the containers may rupture violently and rocket.

Names & identifiers

Preferred name
Allene
IUPAC
propa-1,2-diene
English name
1,2-Propadiene
Molecular formula
C3H4
Molecular weight
40.06

Names & synonyms

Allene1,2-PropadienePROPADIENE463-49-0DimethylenemethaneSym-allylene4AV0LZ8QKBDTXSID1029178CHEBI:37601RefChem:868638DTXCID409178207-335-3
Show more names
Propa-1,2-dienePropadiene-d4MFCD00008566CH2=C=CH260731-10-412075-35-3HSDB 5135EINECS 207-335-3

Database identifiers

CAS
12075-35-3、463-49-0、60731-10-4
PubChem CID
10037
DTXSID
DTXSID1029178
ChEMBL
CHEMBL116960
ChEBI
CHEBI:37601
UNII
4AV0LZ8QKB
EC Number
207-335-3
Nikkaji
J3.636F

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
3

Experimental & physicochemical properties

Chemical Classes · 2 items

Toxic Gases & Vapors -> Simple Asphyxiants

Flammable agents - 4th degree

SpringerMaterials PropertiesDunham energy parameter
Density · 2 items

1.787

0.677 @25 °C

Color/Form · 2 items

GAS

COLORLESS

SolubilityINSOL IN WATER; SOL IN BENZENE, PETROLEUM ETHER
Boiling Point · 2 items

-34.5 °C @ 760 MM HG

-34.5 °C @760 [mm Hg]

Physicochemical properties

Symbol(GHS)
2 · GHS02,GHS04
Signal word
Danger
Hazard statements
220 · H220-H280
Precautionary statements
210 · P210-P377-P381-P410+P403

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 0.3% (1 of 317) of reports.

Danger

H220 (87.7%): Extremely flammable gas [Danger Flammable gases]

P203, P210, P222, P280, P377, P381, P403, and P410+P403 (click each P-code to see the statement)

Aggregated GHS information provided per 317 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 5 items

Chemical: 1,2-Propadiene

1,2-Propadiene is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Propadiene are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 18-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24896

1,2-propadiene: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelFlammable Gas
Fire Hazards · 2 items

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:

· EXTREMELY FLAMMABLE.

Fire PotentialFLAMMABLE; DANGEROUS FIRE RISK.
Health Hazards · 2 items

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:

· Vapors may cause dizziness or asphyxiation without warning, especially when in closed or confined areas.

Hazards SummaryInhaling high concentrations can cause lightheadedness and syncope; [NJ-HSFS] Liquefied gas may cause frostbite. A simple asphyxiant; [CAMEO] Propadiene, stabilized (UN2200) has warning of explosive polymerization; [ERG 2016]

Safety & protection

Fire FightingExcerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:
Accidental Release Measures · 2 items

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 items

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:
Isolation and Evacuation · 2 items

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable); polymerization hazard]:

Immediate precautionary measure

Toxicology

Adverse EffectsNeurotoxin - Acute solvent syndrome

Regulatory information

DHS Chemicals of Interest (COI) · 4 items

Propadiene

1

10000

Flammable chemical that can be released at a facility.

Safety data

Signal word
Danger
Symbol(GHS)
GHS02,GHS04
Hazard statements
H220-H280
Precautionary statements
P210-P377-P381-P410+P403

Chemistry & industry

Uses & manufacturing

Uses · 4 items

Used as a chemical intermediate, a fuel gas for welding when mixed with propyne, and a monomer; [HSDB]

Gas Welding and Cutting [Category: Weld]

CHAIN-TRANSFER REAGENT IN PRODN OF POLYBUTADIENE; FUEL GAS FOR METAL-WORKING INDUSTRY (MIXT WITH PROPYNE); MONOMER FOR ALLENE POLYMERS (POSSIBLE USE)

CHEM INT IN PRODN OF ITS ISOMER, PROPYNE, METHYLENENORBORNENE, IN HYDROBORATION REACTIONS (POSSIBLE USE)

U.S. Exports · 2 items

(1977) No Data

(1979) No Data

U.S. Imports · 2 items

(1977) No Data

(1979) No Data

U.S. Production · 3 items

2023: 500,000 - <1,000,000 lb

(1977) MORE THAN 2.72X10+6 G-MIXT WITH PROPYNE

(1979) MORE THAN 2.72X10+6 G-MIXT WITH PROPYNE

Consumer UsesIntermediate
Industry UsesIntermediate

Suppliers34 total

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
江西核研院新材料有限公司18901398682 18901398682 · [email protected]
聊城信立新材料有限公司18963527911 18006357927 · [email protected]
湖南省华中特种气体有限公司0734-8755555 15674722888 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

Related reactions

8 records

Compound notes

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