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13288-50-1

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Basic Information
CAS No.: 13288-50-1
Name: N-(1-METHYLUNDECYL) ACRYLAMIDE
Molecular Structure:
Molecular Structure of 13288-50-1 (N-(1-METHYLUNDECYL) ACRYLAMIDE)
Formula: C15H29NO
Molecular Weight: 239.401
Synonyms: Acrylamide,N-(1-methylundecyl)- (7CI,8CI);N-(2-Dodecyl)acrylamide;N-(Dodecan-2-yl)prop-2-enamide;N-(1-Methylundecyl) acrylamide;N-(1-Methylundecyl)-2-propenamide;
EINECS: 236-301-0
Density: 0.862 g/cm3
Boiling Point: 369.3 °C at 760 mmHg
Flash Point: 226.6 °C
PSA: 29.10000
LogP: 4.59880
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Specification

The 2-Propenamide,N-(1-methylundecyl)-, with the CAS registry number 13288-50-1, is also known as N-(1-Methylundecyl) acrylamide. Its EINECS number is 236-301-0. This chemical's molecular formula is C15H29NO and molecular weight is 239.4. What's more, its systematic name is N-(Dodecan-2-yl)prop-2-enamide. Its classification code is TSCA Flag P.

Physical properties of 2-Propenamide,N-(1-methylundecyl)- are: (1)ACD/LogP: 4.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.98; (4)ACD/LogD (pH 7.4): 4.98; (5)ACD/BCF (pH 5.5): 3572.56; (6)ACD/BCF (pH 7.4): 3572.56; (7)ACD/KOC (pH 5.5): 12156.73; (8)ACD/KOC (pH 7.4): 12156.73; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.451; (14)Molar Refractivity: 74.85 cm3; (15)Molar Volume: 277.5 cm3; (16)Polarizability: 29.67×10-24 cm3; (17)Surface Tension: 29.7 dyne/cm; (18)Density: 0.862 g/cm3; (19)Flash Point: 226.6 °C; (20)Enthalpy of Vaporization: 61.6 kJ/mol; (21)Boiling Point: 369.3 °C at 760 mmHg; (22)Vapour Pressure: 1.2E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NC(CCCCCCCCCC)C)\C=C
(2)InChI: InChI=1S/C15H29NO/c1-4-6-7-8-9-10-11-12-13-14(3)16-15(17)5-2/h5,14H,2,4,6-13H2,1,3H3,(H,16,17)
(3)InChIKey: ACALHKQKISMQQT-UHFFFAOYSA-N