(Q81981588)

English

4,4-Dimethylpentanoic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

branched chain fatty acids

0 references

130.099379688 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₇H₁₄O₂

0 references

canonical SMILES

CC(C)(C)CCC(=O)O

0 references

Identifiers

InChI=1S/C7H14O2/c1-7(2,3)5-4-6(8)9/h4-5H2,1-3H3,(H,8,9)

0 references

HMMSZUQCCUWXRA-UHFFFAOYSA-N

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CAS Registry Number

1 reference

HMMSZUQCCUWXRA-UHFFFAOYSA-N

CAS Common Chemistry

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1118-47-4

1 reference

matched by identifier from

HMMSZUQCCUWXRA-UHFFFAOYSA-N

mapping relation type

2 references

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C7H14O2/c1-7(2,3)5-4-6(8)9/h4-5H2,1-3H3,(H,8,9)

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

HMMSZUQCCUWXRA-UHFFFAOYSA-N

UniChem compound ID

1 reference

NMRShiftDB structure ID

1 reference

matched by identifier from

HMMSZUQCCUWXRA-UHFFFAOYSA-N

DSSTox substance ID

1 reference

matched by identifier from

HMMSZUQCCUWXRA-UHFFFAOYSA-N

DSSTOX compound identifier

0 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

30 June 2018

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Multilingual sites(0 entries)

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