CAS Registry Number®
84-80-0
CAS Name
Phylloquinone
Molecular Formula
C31H46O2
Molecular Mass
450.70
Compound Properties
-
Boiling Point (1)
140-145 °C @ Press: 1 x 10-3 Torr
-
Melting Point (1)
-20 °C
-
Density (1)
0.964 g/cm3 @ Temp: 25 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1
InChIKey
InChIKey=MBWXNTAXLNYFJB-NKFFZRIASA-N
SMILES
O=C1C=2C(C(=O)C(C)=C1C/C=C(/CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)\C)=CC=CC2
Canonical SMILES
O=C1C=2C=CC=CC2C(=O)C(=C1C)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C
Other Names for this Substance
- 1,4-Naphthalenedione, 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-
- Phylloquinone
- 1,4-Naphthalenedione, 2-methyl-3-(3,7,11,15-tetramethyl-2-hexadecenyl)-, [R-[R*,R*-(E)]]-
- 1,4-Naphthalenedione, 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecenyl]-
- 2-Methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthalenedione
- Antihemorrhagic vitamin
- Mephyton
- 2-Methyl-3-phytyl-1,4-naphthoquinone
- Mono-Kay
- Phytomenadione
- Phytonadione
- Phytylmenadione
- Vitamin K1(20)
- α-Phylloquinone
- Konakion
- trans-Phylloquinone
- 2′,3′-trans-Vitamin K1
- Synthex P
- Kephton
- Kinadion
- Monodion
- Combinal K1
- Kativ N
- AquaMEPHYTON
- Kaywan
- Phylloquinone K1
- Phytylmenaquinone
- Pediatrico
- Orakay
- Veta K1
- Veda K1
- NSC 270681
- Kanakion
- Amri-K
- Haemokion
- Kenadion
- Reconval
Deleted or Replaced CAS Registry Numbers
10485-69-5, 15973-57-6, 50926-17-5
