Basic information
- CAS
1441-56-1- Standard SMILES
[1H]C([1H])=C([1H])C([1H])=C([1H])[1H]- InChIKey
KAKZBPTYRLMSJV-UFSLNRCZSA-N- Molecular formula
- C4H6
- Average molar mass
- 54.09 g/mol
Overview
See also: 1,3-Butadiene-1,1,2,3,4,4-d6 (annotation moved to).
Names & identifiers
- Preferred name
- 1,3-Butadiene-d6
- IUPAC
- 1,1,2,3,4,4-hexaprotiobuta-1,3-diene
- English name
- 1,3-BUTADIENE-D6
- Molecular formula
- C4D6
- Molecular weight
- 60.13
Names & synonyms
1,3-Butadiene-d6RefChem:414122686-070-91,1,2,3,4,4-hexaprotiobuta-1,3-diene1441-56-11,3-Butadiene, hexadeutero-, trans-KAKZBPTYRLMSJV-JIXMDAJQSA-Nbutadiene-d61,3-Butadiene-d1,3-Butadiene-D6 (gas)1,3-Butadiene-1,1,2,3,4,4-d61,3-BUTADIENE-D6, 98 ATOM % D
Show more names
1,3-Butadiene, hexadeutero-, (E)-1,3-Butadiene (D?, 98%) + hydroquinone1,3-BUTADIENE (D6, 98%) + HYDROQUINONE
Database identifiers
- CAS
1441-56-1- PubChem CID
- 137009
- EC Number
- 686-070-9
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 4
- Formal charge
- 0
- Complexity
- 21
Physicochemical properties
- Melting point
- 109 °C · −109 °C(lit.)
- Boiling point
- 4.5 °C · −4.5 °C(lit.)
- vapor density
- (vs air)
- vapor pressure
- 3102 mm · 3102 mm Hg ( 37.7 °C)
- CAS Number Unlabeled
- 106 · 106-99-0
- Symbol(GHS)
- 2 · GHS02,GHS04,GHS08
- Signal word
- Danger
- Hazard statements
- 220 · H220-H280-H340-H350
- Precautionary statements
- 201 · P201-P210-P308+P313-P410+P403
- Hazard Codes
- T,F+
- Risk Statements
- 45 · 45-12-46
- Safety Statements
- 53 · 53-45
- RIDADR
- 1010 · UN 1010 2.1
- WGK Germany
- 3 · 3
- Autoignition Temperature
- 788 °F · 788 °F
Safety & regulation
GHS classification
GHS Classification
Danger
H220 (100%): Extremely flammable gas [Danger Flammable gases]
P203, P210, P222, P280, P318, P377, P381, P403, P405, P410+P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Gas 1 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 1010 2.1
- risk_code
- 45-12-46
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS04,GHS08
- hazard_code
- T,F+
- safety_code
- 53-45
- Hazard statements
- H220-H280-H340-H350
- Autoignition Temperature
- 788 °F
- Precautionary statements
- P201-P210-P308+P313-P410+P403
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers16 total
安徽旺山旺水特种气体有限公司15906197626 · [email protected]
江西核研院新材料有限公司18901398682 18901398682 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
尚澜气体（上海）有限公司4001882517 13323475516 · [email protected]
上海嘉斯保气体有限公司13218776790 13218776790 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
热耳科技（上海）有限公司021-64400900 15800436310 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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