101691-39-8
THEOPHYLLINE-7-ACETIC ACID ESTER OF D,L-TRANS-SOBREROL
Name
THEOPHYLLINE-7-ACETIC ACID ESTER OF D,L-TRANS-SOBREROL
Formula
C19 H26 N4 O5
MolWeight
390.437
1Identification
【Name】
THEOPHYLLINE-7-ACETIC ACID ESTER OF D,L-TRANS-SOBREROL
【CAS】
【MDL】
MFCD01694473
【English Synonyms】
【Formula】
C19 H26 N4 O5
【MolWeight】
390.437
【Inchi】
InChI=1S/C19H26N4O5/c1-11-6-7-12(19(2,3)27)8-13(11)28-14(24)9-23-10-20-16-15(23)17(25)22(5)18(26)21(16)4/h6,10,12-13,27H,7-9H2,1-5H3/t12-,13+/m0/s1
【InChIKey】
InChIKey=GNNTZHHHCVKACU-QWHCGFSZSA-N
【SMILES】
CC1=CC[C@@H](C[C@H]1OC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C)C(C)(C)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
THEOPHYLLINE-7-ACETIC ACID ESTER OF D,L-TRANS-SOBREROL.cml
Quick Release
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Youchemicals Limited
Catalog No:Y19282
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
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Catalog No:Y19282
Country/Region:China
Business Type:Trading Company
http://www.youchemicals.com
More 101691-39-8 Suppliers>>