755039-53-3
BUTANOIC ACID, 2-[(2-CHLORO-5-NITRO-4-PYRIMIDINYL)CYCLOPENTYLAMINO]-, METHYL ESTER, (2R)-
Name
BUTANOIC ACID, 2-[(2-CHLORO-5-NITRO-4-PYRIMIDINYL)CYCLOPENTYLAMINO]-, METHYL ESTER, (2R)-
Formula
C14 H19 Cl N4 O4
MolWeight
342.781
1Identification
【Name】
BUTANOIC ACID, 2-[(2-CHLORO-5-NITRO-4-PYRIMIDINYL)CYCLOPENTYLAMINO]-, METHYL ESTER, (2R)-
【CAS】
【MDL】
MFCD10565695
【English Synonyms】
【Formula】
C14 H19 Cl N4 O4
【MolWeight】
342.781
【Inchi】
InChI=1S/C14H19ClN4O4/c1-3-10(13(20)23-2)18(9-6-4-5-7-9)12-11(19(21)22)8-16-14(15)17-12/h8-10H,3-7H2,1-2H3/t10-/m1/s1
【InChIKey】
InChIKey=GXVLUDDQFWMGHW-SNVBAGLBSA-N
【SMILES】
CC[C@H](C(=O)OC)N(c1c(cnc(n1)Cl)[N+](=O)[O-])C2CCCC2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BUTANOIC ACID, 2-[(2-CHLORO-5-NITRO-4-PYRIMIDINYL)CYCLOPENTYLAMINO]-, METHYL ESTER, (2R)-.cml
Quick Release
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