CAS
100063-12-5 Purity
96%
100063-12-5 Purity
96%
![Ammonium[9,16,23-trisulfamoyl-29H,31H-phthalocyanine-2-sulfonato(3-)-n29,n30,n31,n32]cuprate(1-)](https://resource.alfa-chemistry.com/structure/100063-55-6.gif)
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2-[[[2-[(Hydroxymethyl)[2-[(1-oxoisononyl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid
CAS
100063-56-7
Catalog Number
ACM100063567
Category
Other Products
Molecular Weight
421.530400 [g/mol]
Molecular Formula
C22H35N3O5
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Specification
Synonyms
EINECS 309-120-0, CID113542, 2-(((2-((Hydroxymethyl)(2-((1-oxoisononyl)amino)ethyl)amino)ethyl)amino)carbonyl)benzoic acid, 100063-56-7
IUPAC Name
2-[2-[hydroxymethyl-[2-(7-methyloctanoylamino)ethyl]amino]ethylcarbamoyl]benzoic acid
Canonical SMILES
CC(C)CCCCCC(=O)NCCN(CCNC(=O)C1=CC=CC=C1C(=O)O)CO
InChI Key
KXWBMYVIQBCGJO-UHFFFAOYSA-N
Boiling Point
676.6ºC at 760mmHg
Flash Point
363ºC
Density
1.145g/cm³
EC Number
309-120-0
Exact Mass
421.25800
H-Bond Acceptor
6
H-Bond Donor
4
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CAS
100063-59-0 Purity
96%
100063-59-0 Purity
96%
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CAS
100063-60-3 Purity
96%
100063-60-3 Purity
96%
