2,4-Dichloro-7H-pyrrolo[2,3-d]pyriMidine

2,4-Dichloro-7H-pyrrolo[2,3-d]pyriMidine structure
CAS番号90213-66-4
分子式C6H3Cl2N3
分子量188.01 g/mol
外観White to off-white solid
融点247-250 °C
SMILESClc1nc(Cl)c2cc[nH]c2n1
InChIKeyGHXBPCSSQOKKGB-UHFFFAOYSA-N
製品説明2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine, with 2,4-dichloro substitution. Both chlorides undergo regioselective nucleophilic substitution for 2,4-disubstituted pyrrolopyrimidine drugs.
用途Pharmaceutical intermediate; pyrrolopyrimidine; dichloro substrate
危険物等級Skin Irrit. 2; Eye Irrit. 2; STOT SE 3 (Resp)
危険有害性情報H315; H319; H335
注意性情報P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501

計算・予測物性

推定沸点312.0 °C (予測値)
推定密度1.79 g/cm³ (予測値)