Basic information
- CAS
14590-54-6- Standard SMILES
O=C(O)[C@H]1C[C@@H]1C(=O)O- InChIKey
RLWFMZKPPHHHCB-HRFVKAFMSA-N- Molecular formula
- C5H6O4
- Average molar mass
- 130.1 g/mol
- Monoisotopic mass
- 130.02660867
Names & identifiers
- Preferred name
- (1S,2S)-cyclopropane-1,2-dicarboxylic acid
- IUPAC
- trans-(1S,2S)-cyclopropane-1,2-dicarboxylic acid
- English name
- (1S,2S)-Cyclopropane-1,2-dicarboxylic acid
- Molecular formula
- C5H6O4
- Molecular weight
- 130.1
Names & synonyms
(1S,2S)-cyclopropane-1,2-dicarboxylic acid14590-54-6DTXSID30426118RefChem:1049506DTXCID80376952(1S,2S)-1,2-Cyclopropanedicarboxylic AcidMFCD062276171,2-Cyclopropanedicarboxylic acid, (1S,2S)-(1S,2S)-1-methylcyclopropane-1,2-dicarboxylic acid1,2-Cyclopropanedicarboxylic acid, (1S-trans)-1alpha,2beta-Cyclopropanedicarboxylic acid(1S)-Cyclopropane-1alpha,2beta-dicarboxylic acid
Show more names
1α,2β-Cyclopropanedicarboxylic acid(1S)-Cyclopropane-1α,2β-dicarboxylic acid
SCHEMBL8495522AKOS0168441931,2-Cyclopropanedicarboxylic acid, (E)-AS-49477SY269378(1S2S)-Cyclopropane-12-dicarboxylic acid(1S,2S)-cyclopropane-1,2-dicarboxylicacidDS-017943
Database identifiers
- CAS
14590-54-6- PubChem CID
- 6928367
- DTXSID
DTXSID30426118- Nikkaji
- J81.785F
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 144
Physicochemical properties
- Melting point
- 168 · 168-169 °C
- Boiling point
- 305.8 · 305.8±25.0 °C(Predicted)
- Density
- 1.673 · 1.673±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- solubility
- DMSO (Slightly), Ethanol (Slightly)
- form
- Solid
- pka
- 3.84 · 3.84±0.11(Predicted)
- color
- White to Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses(1S,2S)-1,2-Cyclopropanedicarboxylic acid is an reagent used in the synthesis of bleomycin (B595800), a antitumor and antibiotic agent.
Uses(1S,2S)-cyclopropane-1,2-dicarboxylic acid is an reagent used in the synthesis of bleomycin (B595800), a antitumor and antibiotic agent.
Suppliers28 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
合肥恩立医药科技有限公司0551-66399836 18955197623 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
CEG Chemical Science & Technology Co., Ltd.Mobile:13665161512
天津安浩生物科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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