2,5-Dihydro-2-isopropyl-3,6-dimethoxypyrazine

HCID 3800909

Basic information

CAS
148403-14-9
Standard SMILES
COC1=NC(C(C)C)C(OC)=NC1
InChIKey
FCFWEOGTZZPCTO-UHFFFAOYSA-N
Molecular formula
C9H16N2O2
Average molar mass
184.24 g/mol
Monoisotopic mass
184.12117775

Overview

structure in first source

Names & identifiers

Preferred name
2,5-Dihydro-2-isopropyl-3,6-dimethoxypyrazine
IUPAC
3,6-dimethoxy-2-propan-2-yl-2,5-dihydropyrazine
English name
Pyrazine, 2,5-dihydro-3,6-dimethoxy-2-(1-methylethyl)- (9CI)
Molecular formula
C9H16N2O2
Molecular weight
184.24

Names & synonyms

RefChem:2723862,5-DID cpd2,5-dihydro-2-isopropyl-3,6-dimethoxypyrazine148403-14-92-isopropyl-3,6-dimethoxy-2,5-dihydropyrazine3,6-dimethoxy-2-(propan-2-yl)-2,5-dihydropyrazine3,6-dimethoxy-2-propan-2-yl-2,5-dihydropyrazinePyrazine, 2,5-dihydro-3,6-dimethoxy-2-(1-methylethyl)-Pyrazine, 2,5-dihydro-3,6-dimethoxy-2-(1-methylethyl)- (9CI)(R)-2,5-Dimethoxy-3-isopropyl-3,6-dihydropyrazine2,5-Dihydro-3,6-dimethoxy-2-isopropylpyrazineBislactim ether; Sch?llkopf
Show more names
3,6-DIMETHOXY-2-(1-METHYLETHYL)-2,5-DIHYDROPYRAZINE
SCHEMBL206183DTXSID70396609FCFWEOGTZZPCTO-UHFFFAOYSA-NMFCD01104347AKOS024365350SB13059DA-10065LS-13678

Database identifiers

CAS
148403-14-9
PubChem CID
3800909
DTXSID
DTXSID70396609

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
43.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
13

Physicochemical properties

Boiling point
245.2 · 245.2±33.0 °C(Predicted)
Density
1.09 · 1.09±0.1 g/cm3(Predicted)
pka
3.81 · 3.81±0.60(Predicted)

Chemistry & industry

Suppliers10 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
成都科瑞嘉医药科技有限公司18290480864 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]

Related reactions

19 records

Compound notes

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