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(1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate structure
Fine Chemical

(1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate

TL;DR: (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate (CAS 1212112-89-4) is a chemical compound with molecular formula C27H35NO6 and molecular weight 469.24643 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-2-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylate

Also Known As: (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate, (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-2-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylate, 3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl trans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate

CAS Number
1212112-89-4
Molecular Formula
C27H35NO6
Molecular Weight
469.24643 g/mol
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Technical Specifications

Molecular FormulaC27H35NO6
Molecular Weight469.24643 g/mol
XLogP5.1
Topological Polar Surface Area (TPSA)90.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds7
Exact Mass469.24643 Da
Heavy Atoms34
Complexity819.0
SMILESCC1=CC2=C(C=C1OC(=O)C3CCC(CC3)CNC(=O)OC(C)(C)C)C4=C(CCCC4)C(=O)O2
InChIKeyRINSIIGSFWCSTA-UHFFFAOYSA-N

Chemical Property Profile of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate

XLogP
5.1
TPSA (Topological Polar Surface Area)
90.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
7
Heavy Atoms
34
Complexity
819.0
Exact Mass
469.24643
Monoisotopic Mass
469.24643
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate

The XLogP value of 5.1 indicates that (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate. Following Lipinski's Rule of Five, (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate?

The CAS number of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate is 1212112-89-4.

What is the molecular formula of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate?

The molecular formula of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate is C27H35NO6.

What is the molecular weight of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate?

The molecular weight of (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate is 469.24643 g/mol.

Where can I buy (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate?

You can request a quote for (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate?

Yes, CoreyChem provides custom synthesis services for (1r,4r)-3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-2-yl 4-(((tert-butoxycarbonyl)amino)methyl)cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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