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Molecule

1,4-Butanediol, Diacrylate

CAS: 1070-70-8 · C10H14O4

2D Structure

3D Structure

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Basic Information

CAS Registry Number
1070-70-8
Molecular Formula
C10H14O4
Molecular Mass
198.22 g/mol

Identifiers

CAS Registry Number

1070-70-8

SMILES

C=CC(=O)OCCCCOC(=O)C=C

InChI Key

JHWGFJBTMHEZME-UHFFFAOYSA-N

InChI

InChI=1S/C10H14O4/c1-3-9(11)13-7-5-6-8-14-10(12)4-2/h3-4H,1-2,5-8H2

Names and Synonyms

  • 1,4-Butanediol, Diacrylate Systematic Name
  • 2-Propenoic acid, 1,1′-(1,4-butanediyl) ester Synonym
  • Acrylic acid, tetramethylene ester Synonym
  • 2-Propenoic acid, 1,4-butanediyl ester Synonym
  • 1,4-Butanediol, diacrylate Synonym
  • 1,4-Butylene glycol diacrylate Synonym
  • Tetramethylene diacrylate Synonym
  • 1,4-Butylene diacrylate Synonym
  • Tetramethylene glycol diacrylate Synonym
  • Tetramethylene acrylate Synonym
  • SR 213 Synonym
  • Viscoat 195 Synonym
  • Laromer BDDA Synonym
  • Viscoat V 195 Synonym
  • SR 213 (ester) Synonym
  • SM 624 Synonym
  • Fancryl FA 124SA Synonym
  • Fancryl FA 124AS Synonym
  • Miramer 204 Synonym
  • 1,4-Bis(acryloyloxy)butane Synonym
  • Butylene glycol diacrylate Synonym
  • Butane-1,4-diyl diacrylate Synonym
  • FA 124AS Synonym
  • Sartomer 213 Synonym
  • 1,4-Butanediol diacrylate Synonym
  • n-Butane-1,4-diyl diacrylate Synonym
  • M 204 Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 198.22 g/mol CAS Common Chemistry
198.218 g/mol RDKit
Canonical SMILES O=C(OCCCCOC(=O)C=C)C=C CAS Common Chemistry
InChI InChI=1S/C10H14O4/c1-3-9(11)13-7-5-6-8-14-10(12)4-2/h3-4H,1-2,5-8H2 CAS Common Chemistry
InChI Key InChIKey=JHWGFJBTMHEZME-UHFFFAOYSA-N CAS Common Chemistry
Name 1,4-Butanediol, diacrylate CAS Common Chemistry
Heavy Atom Count 14 RDKit
Hydrogen Bond Acceptors 4 RDKit
Hydrogen Bond Donors 0 RDKit
Rotatable Bonds 7 RDKit
Aromatic Ring Count 0 RDKit
Topological Polar Surface Area 52.6 Ų RDKit
LogP 1.2249999999999999 RDKit
1.225 RDKit
Molar Refractivity 51.54600000000003 cm³/mol RDKit
Ring Count 0 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.4 RDKit
Exact Mass 198.089208928 g/mol RDKit
Boiling Point 132-138 °C @ 13 Torr CAS Common Chemistry

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

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MW = 198.22 g/mol. Edit any field — others recompute live.

Related

Related molecules

Other compounds with formula C10H14O4.

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