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Vitamin K2(CAS No. 11032-49-8)

Vitamin K2 C16H16O2?(C5H8)n (cas 11032-49-8) Molecular Structure

11032-49-8 Structure

Identification and Related Records

【Name】
Vitamin K2
【CAS Registry number】
11032-49-8
【EINECS(EC#)】
234-264-5
【Molecular Formula】
C16H16O2?(C5H8)n (Products with the same molecular formula)
【Molecular Weight】
444.65
【Inchi】
InChI=1/C21H24O2/c1-14(2)8-7-9-15(3)12-13-17-16(4)20(22)18-10-5-6-11-19(18)21(17)23/h5-6,8,10-12H,7,9,13H2,1-4H3/b15-12+
【Canonical SMILES】
CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCC=C(C)C
【Isomers smiles】
CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CCC=C(C)C
【MOL File】
11032-49-8.mol

Chemical and Physical Properties

【Appearance】
White crystalline powder
【Density】
1.045 g/cm3
【Boiling Point】
448.6 °C at 760 mmHg
【Vapour】
3.06E-08mmHg at 25°C
【Refractive Index】
1.548
【Flash Point】
167.2 °C
【Storage temp】
?20°C
【Computed Properties】
Molecular Weight:308.41406 [g/mol]
Molecular Formula:C21H24O2
XLogP3:5.2
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:5
Tautomer Count:27
Exact Mass:308.17763
MonoIsotopic Mass:308.17763
Topological Polar Surface Area:34.1
Heavy Atom Count:23
Formal Charge:0
Complexity:571
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:1
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Hydrophobe Count:3
Feature 3D Ring Count:2
Effective Rotor Count:5
Conformer Sampling RMSD:0.8
CID Conformer Count:175

Safety and Handling

【Hazard Codes】
Xi
【Safety Statements 】
22-24/25-37/39-26

Supplier Location

Top Suppliers

Diamond member Wuhan Fortuna Chemical Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:0086-27-59207850
Diamond member Nanjing Bangnuo Biotechnology Co., Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-1732-7098554
Diamond member Wuhan H.X.K Fine Chemicals Co.,LTD
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-27-59721024
Wuhan Golden Wing Industry & Trade Co.,Ltd.
Country:ChinaChina
Business Type:Trading Company
Telephone:86-27-82645123
Wuhan Dahua Weiye Pharmaceutical Co.,Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-27-59212929
Wuhan Senwayer Century chemical Co.,Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-27-59009407
Shanhai Seebio Biotech, Inc
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-21-58183719
Shangqiu Kangmeida Bio-Technology Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-512-51251252
Boc Sciences
Country:United StatesUnited States
Business Type:Manufacturer
Telephone:1-631-5046093
ZHONGBEI NORTHLAND BIO-CHEM INDUSTRY CO., LTD.
Country:ChinaChina
Telephone:+86-452-6197139

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