Structure

Amino-PEG6-alcohol

CAS
39160-70-8
Catalog Number
ACM39160708
Category
Amino PEG Linkers
Molecular Weight
281.35
Molecular Formula
C12H27NO6

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Specification

Description
Amino-PEG6-OH is a non-cleavable 6 unit PEG ADC linker used in the synthesis of antibody-drug conjugates (ADCs).
Synonyms
Amino-PEG6-OH
IUPAC Name
2-[2-[2-[2-[2-(2-Aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Canonical SMILES
C(COCCOCCOCCOCCOCCO)N
InChI
InChI=1S/C12H27NO6/c13-1-3-15-5-7-17-9-11-19-12-10-18-8-6-16-4-2-14/h14H,1-13H2
InChI Key
ICUIZKMGHRMMDZ-UHFFFAOYSA-N
Boiling Point
388.0±37.0 °C at 760 mmHg
Flash Point
188.5±26.5 °C
Density
1.1±0.1 g/cm3
Appearance
Liquid
Storage
-20±5 ºC
Complexity
161
Covalently-Bonded Unit Count
1
Exact Mass
281.18383758
Heavy Atom Count
19
Monoisotopic Mass
281.18383758
Refractive Index
n20/D 1.463(lit.)
Topological Polar Surface Area
92.4 Ų
Type
Heterobifunctional PEG Linkers
What is the IUPAC name of 4-Iodo-2,5-dimethoxyphenethylamine?

The IUPAC name is 2-(4-iodo-2,5-dimethoxyphenyl)ethanamine.

What is the molecular formula of 4-Iodo-2,5-dimethoxyphenethylamine?

The molecular formula is C10H14INO2.

What is the molecular weight of 4-Iodo-2,5-dimethoxyphenethylamine?

The molecular weight is 307.13 g/mol.

What is the Canonical SMILES representation of 4-Iodo-2,5-dimethoxyphenethylamine?

COC1=CC(=C(C=C1CCN)OC)I

What is the InChIKey of 4-Iodo-2,5-dimethoxyphenethylamine?

The InChIKey is PQHQBRJAAZQXHL-UHFFFAOYSA-N.

What is the XLogP3-AA value of 4-Iodo-2,5-dimethoxyphenethylamine?

The XLogP3-AA value is 1.8.

How many hydrogen bond donor counts does 4-Iodo-2,5-dimethoxyphenethylamine have?

It has 1 hydrogen bond donor count.

How many rotatable bond counts does 4-Iodo-2,5-dimethoxyphenethylamine have?

It has 4 rotatable bond counts.

What is the exact mass of 4-Iodo-2,5-dimethoxyphenethylamine?

The exact mass is 307.00693 g/mol.

How many covalently-bonded unit counts does 4-Iodo-2,5-dimethoxyphenethylamine have?

It has 1 covalently-bonded unit count.

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