Vitamin K1 Hydroxide

CAT: 0572-TRC-V680005-1MGSize: 1 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-V680005-1MGSize:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

15576-40-6

Synonyms

2-((7R,11R,E)-3-Hydroxy-3,7,11,15-tetramethyl-1-hexadecen-1-yl)-3-methyl-1,4-naphthalenedione; 2-((7R,11R,E)-3-Hydroxy-3,7,11,15-tetramethyl-1-hexadecenyl)-3-methyl-1,4-naphthoquinone; 2-((7R,11R,E)-3-Hydroxy-3,7,11,15-tetramethyl-1-hexadecenyl)-3-methyl-1,4-naphthalenedione;

Hazard Statement

Not a hazardous substance according to GHS.

Purity

>95% (HPLC)

Smiles

O=C1C(/C=C/C(C)(O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)=C(C)C(C2=CC=CC=C21)=O

Molecular Formula

C31H46O3

Molecular Weight

466.7

Shipping Conditions

Ice Packs

Storage Conditions

-20°C

Chemical Information

Vitamin K1 Hydroxide

CAS Number	15576-40-6
PubChem CID	163203238
IUPAC Name	2-[(E,7R,11R)-3-hydroxy-3,7,11,15-tetramethylhexadec-1-enyl]-3-methylnaphthalene-1,4-dione
Molecular Formula	C31H46O3
Molecular Weight	466.7
XLogP	9.2
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	14
Heavy Atom Count	34
Formal Charge	0
Complexity	731

SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)/C=C/C(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O

InChI

InChI=1S/C31H46O3/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-20-31(6,34)21-19-26-25(5)29(32)27-17-7-8-18-28(27)30(26)33/h7-8,17-19,21-24,34H,9-16,20H2,1-6H3/b21-19+/t23-,24-,31?/m1/s1

InChIKey

JLLGIYCYBIMFNP-PGGNBPONSA-N

Chemical Structure

2D Structure

CAS: 15576-40-6

CID: 163203238

Formula: C31H46O3

MW: 466.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	466.7
XLogP3	9.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	14
Exact Mass	466.34469533
Monoisotopic Mass	466.34469533
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	731
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TRC-V676080-1G	Vitamin K1
TRC-V676080-100MG	Vitamin K1
TRC-V676093-0.5MG	Vitamin K1 Hydroperoxide
TRC-V676090-5MG	Vitamin K1(25)
TRC-V676083-1MG	Vitamin K1-d7
TRC-V676070-2MG	cis-Vitamin K1
TRC-V676093-2.5MG	Vitamin K1 Hydroperoxide
TRC-V676070-1MG	cis-Vitamin K1
TRC-V676083-10MG	Vitamin K1-d7
TRC-V676093-5MG	Vitamin K1 Hydroperoxide

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468743	Vitamin K1 Hydroxide
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T88645-01	Calcium hydroxide
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Vitamin K1 Hydroxide

Chemical Information

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