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2-Propen-1-ol, 2-methyl-, 1,1'-carbonate

HCID 47083
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
64057-79-0
Standard SMILES
C=C(C)COC(=O)OCC(=C)C
InChIKey
SKCUYCAPQSWGBP-UHFFFAOYSA-N
Molecular formula
C9H14O3
Average molar mass
170.21 g/mol
Monoisotopic mass
170.0942943

Names & identifiers

Preferred name
2-Propen-1-ol, 2-methyl-, 1,1'-carbonate
IUPAC
bis(2-methylprop-2-enyl) carbonate
English name
Dimethallyl carbonate
Molecular formula
C9H14O3
Molecular weight
170.21

Names & synonyms

Bis(2-methylallyl) carbonateBis(methallyl) carbonateEINECS 264-645-1BRN 17691422-Methyl-2-propen-1-ol carbonate (2:1)2-Propen-1-ol, 2-methyl-, 1,1'-carbonate4-03-00-00011 (Beilstein Handbook Reference)RefChem:89202264-645-1SKCUYCAPQSWGBP-UHFFFAOYSA-NDimethallyl carbonate64057-79-0
Show more names
DIMETHYLALLYL CARBONATE2-methyl-2-propen-1-ocarbonate(2:1)carbonicacid,bis(2-methylallyl)ester2-methyl-2-Propen-1-ol 1,1'-carbonate
bis(2-methylprop-2-enyl) carbonateBis(2-Methyl-2-propenyl) carbonate2-Propen-1-ol, 2-methyl-, carbonate (2:1)MFCD00008598CARBONIC ACID, BIS(2-METHYLALLYL) ESTERbis(2-methylprop-2-en-1-yl) carbonate2-methyl allyl carbonatebis(2-methylallyl)carbonate

Database identifiers

CAS
64057-79-0
PubChem CID
47083
DTXSID
DTXSID30948082
EC Number
264-645-1
Nikkaji
J68.702B

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
12
Formal charge
0
Complexity
174

Physicochemical properties

Melting point
201.3 °C · 201.3°C
Boiling point
199 · 199-202°C
Density
0.943 · 0.9430
refractive index
1.4371 · 1.4371
Flash point
199 · 199-202°C
EPA Substance Registry System
2 · 2-Propen-1-ol, 2-methyl-, carbonate (2:1) (64057-79-0)
Risk Statements
10 · 10
Safety Statements
16 · 16
RIDADR
1993 · 1993
RTECS
8750000 · FF8750000
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed
rtecs
FF8750000
ridadr
1993
risk_code
10
safety_code
16

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Propen-1-ol, 2-methyl-, 1,1'-carbonate: INACTIVE

Applications

UsesIt is used as an intermediate in enantioselective tsuji enol silane allylation reaction.

Suppliers9 total

Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

1 records
New reaction record
HRID 542578 reaction equation
HRID 542578As productuspto-grants-1987_04

Compound notes

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