Starburst(R)(pamam)dendrimer,generation 1

• CAS: 142986-44-5
• Catalog Number: ACM142986445
• Category: Nanoparticles & Nanopowders
• Molecular Weight: 1429.8g/mol
• Molecular Formula: C62H128N26O12
• Synonyms: STARBURST(R) (PAMAM) DENDRIMER, GENERATION 1;STARBURST (PAMAM) DENDRIMER, GENERATION 1, 20 WT. % SOLUTION IN METHYL ALCOHOL;pamam dendrimer, generation 1 solution;PAMAMdendrimer,ethylenediaminecore,generation1.0solution;PAMAM dendrimer, ethylenediamine core, generation 1.0 solution 20 wt. % in methanol
• IUPAC Name: N-(2-aminoethyl)-3-[[3-(2-aminoethylamino)-3-oxopropyl]-[2-[3-[[3-[2-[bis[3-(2-aminoethylamino)-3-oxopropyl]amino]ethylamino]-3-oxopropyl]-[2-[bis[3-[2-[bis[3-(2-aminoethylamino)-3-oxopropyl]amino]ethylamino]-3-oxopropyl]amino]ethyl]amino]propanoylamino]ethyl]amino]propanamide
• Canonical SMILES: C(CN(CCC(=O)NCCN)CCNC(=O)CCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)C(=O)NCCN
• InChI: InChI=1S/C62H128N26O12/c63-13-21-71-51(89)1-33-83(34-2-52(90)72-22-14-64)45-29-79-59(97)9-41-87(42-10-60(98)80-30-46-84(35-3-53(91)73-23-15-65)36-4-54(92)74-24-16-66)49-50-88(43-11-61(99)81-31-47-85(37-5-55(93)75-25-17-67)38-6-56(94)76-26-18-68)44-12-62(100)82-32-48-86(39-7-57(95)77-27-19-69)40-8-58(96)78-28-20-70/h1-50,63-70H2,(H,71,89)(H,72,90)(H,73,91)(H,74,92)(H,75,93)(H,76,94)(H,77,95)(H,78,96)(H,79,97)(H,80,98)(H,81,99)(H,82,100)
• InChI Key: QVWIZHOFYGKROL-UHFFFAOYSA-N
• Boiling Point: 64.7°C
• Flash Point: 52°F
• Density: 0.82g/mL at 25°C
• Appearance: 20 wt.% in methanol
• Complexity: 1890
• Covalently-Bonded Unit Count: 1
• Exact Mass: 1429.020504g/mol
• Formal Charge: 0
• Hazard Statements: F,T
• H-Bond Acceptor: 26
• H-Bond Donor: 20
• Heavy Atom Count: 100
• Monoisotopic Mass: 1429.020504g/mol
• Rotatable Bond Count: 67
• Safety Description: 7-16-23-45-36/37-26
• Supplemental Hazard Statements: H225-H301+H311+H331-H315-H319-H335-H370
• Symbol: GHS02,GHS06,GHS08
• XLogP3: -16.1

Custom Q&A

What is the molecular weight of Starburst(R)(pamam)dendrimer, generation 1?

The molecular weight of Starburst(R)(pamam)dendrimer, generation 1 is 1429.8 g/mol.

What is the IUPAC Name of Starburst(R)(pamam)dendrimer, generation 1?

The IUPAC Name of Starburst(R)(pamam)dendrimer, generation 1 is N-(2-aminoethyl)-3-[[3-(2-aminoethylamino)-3-oxopropyl]-[2-[3-[[3-[2-[bis[3-(2-aminoethylamino)-3-oxopropyl]amino]ethylamino]-3-oxopropyl]-[2-[bis[3-[2-[bis[3-(2-aminoethylamino)-3-oxopropyl]amino]ethylamino]-3-oxopropyl]amino]ethyl]amino]propanoylamino]ethyl]amino]propanamide.

What is the Canonical SMILES of Starburst(R)(pamam)dendrimer, generation 1?

The Canonical SMILES of Starburst(R)(pamam)dendrimer, generation 1 is C(CN(CCC(=O)NCCN)CCNC(=O)CCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)C(=O)NCCN.

Which software computed the InChI of Starburst(R)(pamam)dendrimer, generation 1?

The InChI was computed by InChI 1.0.6.

What is the InChIKey of Starburst(R)(pamam)dendrimer, generation 1?

The InChIKey of Starburst(R)(pamam)dendrimer, generation 1 is QVWIZHOFYGKROL-UHFFFAOYSA-N.

What is the XLogP3-AA value of Starburst(R)(pamam)dendrimer, generation 1?

The XLogP3-AA value of Starburst(R)(pamam)dendrimer, generation 1 is -16.1.

How many hydrogen bond donor counts are there in Starburst(R)(pamam)dendrimer, generation 1?

There are 20 hydrogen bond donor counts in Starburst(R)(pamam)dendrimer, generation 1.

How many hydrogen bond acceptor counts are there in Starburst(R)(pamam)dendrimer, generation 1?

There are 26 hydrogen bond acceptor counts in Starburst(R)(pamam)dendrimer, generation 1.

What is the topological polar surface area of Starburst(R)(pamam)dendrimer, generation 1?

The topological polar surface area is 577Ų.

What is the formal charge of Starburst(R)(pamam)dendrimer, generation 1?

The formal charge of Starburst(R)(pamam)dendrimer, generation 1 is 0.