tert-butyl 4-chloro-8,9-dihydro-5H-pyrimido[5,4-d]azepine-7(6H)-carboxylate

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Catalog Number
ACM1057338278
Product Name
tert-butyl 4-chloro-8,9-dihydro-5H-pyrimido[5,4-d]azepine-7(6H)-carboxylate
Structure
Structure
CAS
1057338-27-8
Category
Heterocyclic Organic Compound
Synonyms
1057338-27-8, tert-Butyl 4-chloro-8,9-dihydro-5H-pyrimido[4,5-d]azepine-7(6H)-carboxylate, tert-butyl 4-chloro-8,9-dihydro-5H-pyrimido[5,4-d]azepine-7(6H)-carboxylate, CTK4A4051, MolPort-006-170-676, ANW-65486, ZINC32099184, AKOS016005494, AG-D-19540, AK102694, AM802878, KB-260716
IUPAC Name
tert-butyl 4-chloro-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-7-carboxylate
Molecular Weight
283.75
Molecular Formula
C13H18ClN3O2
Canonical SMILES
CC(C)(C)OC(=O)N1CCC2=C(CC1)N=CN=C2Cl
InChI Key
OWQQLMMARYLDAW-UHFFFAOYSA-N
Exact Mass
283.10900
H-Bond Acceptor
4
H-Bond Donor
0
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