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Reference substances

Reference substances

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General information

Inventory

EC number:
203-572-1
EC name:
Propylene carbonate
CAS number:
108-32-7

No inventory information available

Reference substance information

IUPAC name:
4-methyl-1,3-dioxolan-2-one
Synonyms
Names:
1, 2-Propanediol carbonate
1, 2-Propanediyl carbonate
1,2-Propanediol cyclic carbonate
1,3-Dioxolan-2-one, 4-methyl-
Carbonic acid cyclic 1,2-propylene ester
Identifier:
CAS number
108-32-7
Identifier:
IUPAC name
2-(carboxyoxy)-1-methylethyl carbonate
Identifier:
IUPAC name
Propylene Carbonate
Identifier:
IUPAC name
Propylene carbonate
Identifier:
IUPAC name
Propylene carbonate
Identifier:
common name
2-Oxo-4-methyl-1,3-dioxolan
Identifier:
common name
4-Methyl-1,3-dioxolan-2-one
Identifier:
other: InChl
1S/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3
Identifier:
other: Molecular formula
C4H6O3
Identifier:
other: SMILES notation
CC1COC(=O)O1
Identifier:
other: InChl
InChI=1/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3
Identifier:
other: InChl
InChI=1/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3 AuxInfo=1/0/N:1,3,2,5,6,4,7/rA:7CCCOCOO/rB:s1;s2;s3;s4;d5;s2s5;/rC:6.1249,-7.8841,0;6.1249,-9.4241,0;7.3708,-10.3293,0;6.8949,-11.7939,0;5.3549,-11.7939,0;4.4497,-13.0398,0;4.879,-10.3293,0;
Identifier:
other: InChl
InChI=1/C5H8O6/c1-3(11-5(8)9)2-10-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/p-1
Identifier:
other: InChl
InChI=1S/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3
Identifier:
other: SMILES notation
O=C1OCC(C)O1
Identifier:
other: SMILES notation
OC(=O)OCC(C)OC(=O)[O-]
Identifier:
other: Abbreviation
PC
4-methyl-1,3-dioxolan-2-one

CAS information

CAS number:
108-32-7

Molecular and structural information

Molecular formula:
C4H6O3
Molecular weight:
120
SMILES notation:
CC1COC(=O)O1
InChl:
1/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3
Structural formula:
Chemical structure