Basic information
- CAS
3002-80-0- Standard SMILES
Cc1cnc2c(ccc3cc(C)cnc32)c1- InChIKey
KSACKJIWQPGKMJ-UHFFFAOYSA-N- Molecular formula
- C14H12N2
- Average molar mass
- 208.26 g/mol
- Monoisotopic mass
- 208.10004838
Names & identifiers
- Preferred name
- 3,8-Dimethyl-1,10-phenanthroline
- IUPAC
- 3,8-dimethyl-1,10-phenanthroline
- English name
- 1,10-Phenanthroline, 3,8-dimethyl-
- Molecular formula
- C14H12N2
- Molecular weight
- 208.26
Names & synonyms
3,8-dimethyl-1,10-phenanthroline3002-80-0DTXSID90514429RefChem:272761DTXCID004652361,10-Phenanthroline, 3,8-dimethyl-CHEMBL2205809SCHEMBL686948SCHEMBL30492603BDBM50401353
Database identifiers
- CAS
3002-80-0- PubChem CID
- 12987698
- DTXSID
DTXSID90514429- ChEMBL
CHEMBL2205809- Nikkaji
- J2.061.172C
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Melting point
- 212 °C · 212 °C
- Boiling point
- 393.8 · 393.8±37.0 °C(Predicted)
- Density
- 1.178 · 1.178±0.06 g/cm3(Predicted)
- pka
- 5.32 · 5.32±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers9 total
河北凯诺新材料科技有限公司15932779957 or 18131036894 15932779957 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
上海枧维医药科技有限公司17717331436 17717331436 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
Henan Lavoisier Chemical Products Co.Ltd+86-86-37163682289 +8615981966935 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
Related reactions
1 records
Compound notes
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