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Substance Name: 1,3-Pentanediol
RN: 3174-67-2
InChIKey: RUOPINZRYMFPBF-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Unspecified / Unclassified Pesticide

Molecular Formula

  • C5-H12-O2

Molecular Weight

  • 104.148
 
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Names and Synonyms

Name of Substance

  • 1,3-Pentanediol

Synonyms

  • 4-01-00-02538 (Beilstein Handbook Reference)
  • BRN 1732200

Systematic Name

  • 1,3-Pentanediol

Registry Numbers

CAS Registry Number

  • 3174-67-2

System Generated Number

  • 0003174672

Structure Descriptors

InChI

1S/C5H12O2/c1-2-5(7)3-4-6/h5-7H,2-4H2,1H3

InChIKey

RUOPINZRYMFPBF-UHFFFAOYSA-N

Smiles

C(C[C@@H](CC)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 20gm/kg (20000mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 23, Pg. 418, 1975.