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Substance Name: Adipic acid [NF]
RN: 124-04-9
UNII: 76A0JE0FKJ
InChIKey: WNLRTRBMVRJNCN-UHFFFAOYSA-N
Molecular Formula
- C6-H10-O4
Molecular Weight
- 146.141
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- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
Classification Codes
Classification Codes
- Mutation Data
- Skin / Eye Irritant
Superlist Classification Codes
- Reportable Quantity (RQ) = 5000 lb
- TWA 5 mg/m3
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Names and Synonyms
Name of Substance
- Adipic acid
- Adipic acid [NF]
- Hexanedioic acid
Synonyms
- 1,4-Butanedicarboxylic acid
- 1,6-Hexanedioic acid
- 4-02-00-01956 (Beilstein Handbook Reference)
- Acide adipique
- Acide adipique [French]
- Acifloctin
- Acinetten
- Adilactetten
- Adipate
- Adipic acid
- Adipinic acid
- Adipinsaure
- Adipinsaure [German]
- AI3-03700
- BRN 1209788
- CCRIS 812
- EC 204-673-3
- EINECS 204-673-3
- FEMA No. 2011
- FEMA Number 2011
- Hexanedioic acid
- HSDB 188
- Kyselina adipova
- Kyselina adipova [Czech]
- Molten adipic acid
- NSC 7622
- UNII-76A0JE0FKJ
Systematic Names
- Adipic acid
- Hexanedioic acid
Superlist Names
- 1,4-Butanedicarboxylic acid
- Adipic acid
- Hexanedioic acid
Registry Numbers
CAS Registry Number
- 124-04-9
FDA UNII
- 76A0JE0FKJ
Other Registry Numbers
- 1186514-28-2
- 2023788-68-1
Related Registry Numbers
- 22322-28-7 (unspecified calcium salt)
- 23311-84-4 (unspecified hydrochloride salt)
- 25666-61-9 (unspecified potassium salt)
- 3385-41-9 (di-ammonium salt)
- 7486-38-6 (di-hydrochloride salt)
- 7486-39-7 (magnesium[1:1] salt)
System Generated Number
- 0000124049
Structure Descriptors
InChI
1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)InChIKey
WNLRTRBMVRJNCN-UHFFFAOYSA-NSmiles
C(CCCCC(O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 680mg/kg (680mg/kg) | BLOOD: HEMORRHAGE BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of Agricultural and Food Chemistry. Vol. 5, Pg. 759, 1957. |
| mouse | LD50 | oral | 1900mg/kg (1900mg/kg) | GASTROINTESTINAL: OTHER CHANGES | Journal of Agricultural and Food Chemistry. Vol. 5, Pg. 759, 1957. |
| rabbit | LD50 | oral | > 11gm/kg (11000mg/kg) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(9), Pg. 72, 1983. | |
| rat | LD50 | intraperitoneal | 275mg/kg (275mg/kg) | BLOOD: HEMORRHAGE BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: OTHER CHANGES | Journal of Agricultural and Food Chemistry. Vol. 5, Pg. 759, 1957. |
| rat | LD50 | oral | > 11gm/kg (11000mg/kg) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(9), Pg. 72, 1983. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 153.2 | deg C | EXP | |
| Boiling Point | 337.5 | deg C | EXP | |
| pKa Dissociation Constant | 4.44 | (none) | EXP | |
| log P (octanol-water) | 0.08 | (none) | EXP | |
| Water Solubility | 3.08E+04 | mg/L | 34 | EXP |
| Henry's Law Constant | 4.71E-12 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 5.59E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.