99764-53-1
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Basic information
- Product Name: (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e
- Synonyms: (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e;cyclo(lysyl-tyrosyl-glycyl-glycyl-phenylalanyl-leucyl)
- CAS NO:99764-53-1
- Molecular Formula: C34H47N7O7
- Molecular Weight: 665.77968
- EINECS: N/A
- Product Categories: N/A
- Mol File: 99764-53-1.mol
- Article Data: 0
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 1124.8°Cat760mmHg
- Flash Point: 634.1°C
- Appearance: /
- Density: 1.163g/cm3
- Vapor Pressure: 0mmHg at 25°C
- Refractive Index: 1.53
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e(CAS DataBase Reference)
- NIST Chemistry Reference: (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e(99764-53-1)
- EPA Substance Registry System: (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e(99764-53-1)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 99764-53-1(Hazardous Substances Data)
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General Description
The chemical "(3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e" is a complex organic compound with a large molecular structure containing a variety of functional groups. It includes amines, benzyl groups, butyl groups, and a hydroxyphenyl group, all arranged in a cyclic arrangement. (3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e has a large molecular weight, and it likely has a high degree of molecular complexity and potential for specific biological activity or chemical reactivity.Check Digit Verification of cas no
The CAS Registry Mumber 99764-53-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,9,7,6 and 4 respectively; the second part has 2 digits, 5 and 3 respectively.Calculate Digit Verification of CAS Registry Number 99764-53:
(7*9)+(6*9)+(5*7)+(4*6)+(3*4)+(2*5)+(1*3)=201
201 % 10 = 1
So 99764-53-1 is a valid CAS Registry Number.
InChI:InChI=1/C34H47N7O7/c1-3-21(2)30-34(48)39-25(11-7-8-16-35)32(46)40-26(18-23-12-14-24(42)15-13-23)31(45)37-19-28(43)36-20-29(44)38-27(33(47)41-30)17-22-9-5-4-6-10-22/h4-6,9-10,12-15,21,25-27,30,42H,3,7-8,11,16-20,35H2,1-2H3,(H,36,43)(H,37,45)(H,38,44)(H,39,48)(H,40,46)(H,41,47)/t21?,25-,26-,27-,30+/m0/s1
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(3S,6S,9R,12S)-6-(4-aminobutyl)-12-benzyl-9-butan-2-yl-3-[(4-hydroxyph enyl)methyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexon e
