N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2-[(2-aminoethyl)carbamoyl]ethyl})amino]dodecyl})amino)propanamide|N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2...

Molecular Formula

C₃₂H₆₈N₁₀O₄

Molecular Mass

656.94692

Exact Mass

656.54250071

InChI

InChI=1S/C32H68N10O4/c33-15-19-37-29(43)11-25-41(26-12-30(44)38-20-16-34)23-9-7-5-3-1-2-4-6-8-10-24-42(27-13-31(45)39-21-17-35)28-14-32(46)40-22-18-36/h1-28,33-36H2,(H,37,43)(H,38,44)(H,39,45)(H,40,46)

InChIKey

MVPBOIZWNUVCLB-UHFFFAOYSA-N

Canonic Smiles

NCCNC(=O)CCN(CCC(=O)NCCN)CCCCCCCCCCCCN(CCC(=O)NCCN)CCC(=O)NCCN

Isomeric Smiles

C(CCCCCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCCCCN(CCC(=O)NCCN)CCC(=O)NCCN

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-20.962734

LogD (pH = 7.4)

-14.06511

Log P

-2.3183315

Molar Refractivity

186.136

Polarizability

73.66544

Polar Surface Area

226.96

Rotatable Bonds

Lipinski's Rule of Five

false

Commercial Catalog

Academic Data

IUPAC Traditional name

N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2-[(2-aminoethyl)carbamoyl]ethyl})amino]dodecyl})amino)propanamide

IUPAC name

N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2-[(2-aminoethyl)carbamoyl]ethyl})amino]dodecyl})amino)propanamide

Synonyms

PAMAM dendrimer, 1,12-diaminododecane core, generation 0.0 solutionPAMAM 树枝状聚合物，1,12-二氨基十二烷核，0.0 代溶液

MDL Number

MFCD05865175

PubChem SID

24881685162228922

PubChem CID

16217508

Product Information

Linear Formula

[NH2(CH2)12NH2]:(G=0);dendri PAMAM(NH2)4

No. of surface groups

Feature

core type 1,12-diaminododecane core (12-carbon core)

Concentration

20 wt. % in methanol

Mol. Weight

generation 0

Description

amino surface groups

Physical Property

MSDS Link

Download link

Hazard Class

GHS Pictograms

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), categories 1,2,3

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

11-23/24/25-39/23/24/25

P210-P260-P280-P301+P310-P311

UN 1230 3/PG 2

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)

H225-H301+H311+H331-H370

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Sigma Aldrich

597309

Features and Benefits
Contains 4 surface amino groups.
Packaging
unit weight includes solvent
Legal Information
Mfg. by Dendritic Nanotechnologies Inc. Licensed for research use only.

No Data Available

Click here to submit data

Commercial Catalog

Academic Data

IUPAC Traditional name

N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2-[(2-aminoethyl)carbamoyl]ethyl})amino]dodecyl})amino)propanamide

IUPAC name

N-(2-aminoethyl)-3-({2-[(2-aminoethyl)carbamoyl]ethyl}({12-[bis({2-[(2-aminoethyl)carbamoyl]ethyl})amino]dodecyl})amino)propanamide

Synonyms

PAMAM dendrimer, 1,12-diaminododecane core, generation 0.0 solutionPAMAM 树枝状聚合物，1,12-二氨基十二烷核，0.0 代溶液

MDL Number

PubChem SID

PubChem CID

597309

Features and Benefits
Contains 4 surface amino groups.
Packaging
unit weight includes solvent
Legal Information
Mfg. by Dendritic Nanotechnologies Inc. Licensed for research use only.

No Data Available

Click here to submit data

Product Information

Linear Formula

[NH2(CH2)12NH2]:(G=0);dendri PAMAM(NH2)4

No. of surface groups

Feature

core type 1,12-diaminododecane core (12-carbon core)

Concentration

20 wt. % in methanol

Mol. Weight

generation 0

Description

amino surface groups

Physical Property

Safety Information

Molecule

ID:134646