Molecular formula
C62H90CoN13O15P

SMILES
CC1=CC2=C(C=C1C)N(C=N2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)([O-])O[C@@H](C)CNC(=O)CC[C@@]\4([C@H](C5[C@]6([C@@]([C@@H](C(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.O.[Co+2]

Fragrance
Odorless	69.25%
Savory	36.02%
Cooling	29.92%
Meaty	28.59%
Roasted	23.39%
Cooked	20.83%
Milky	18.69%
Animal	16.34%
Popcorn	15.4%
Nutty	14.05%

 

Flavor
Bitter	75.66%
Odorless	41.37%
Bland	29.12%
Sweet-like	21.1%
Cedarleaf	19.61%
Mild	19.41%
Taco	19.01%
Nitrile	18.96%
Very mild	18.78%
Roasted peanuts	18.54%

 

Odor impact est.
Low

pKa est.
1.22 (strong acid)

Molecular weight
1347.4 g/mol

Melting point expt.

• 200 °C (decomposes)

Flash point

• 278.96 ˚C est.

Solubility expt.

• Moderately sol lower aliphatic alcohols; practically insoluble in acetone, ether, petroleum ether, halogenated hydrocarbons, benzene, chloroform
• PRACTICALLY INSOL IN CHLOROFORM

• HYDROXOCOBALAMIN

Hydroxocobalamin is primarily used as a vitamin B12 component in pharmaceuticals and dietary supplements for humans and animals; it is also employed as a source of cobalamin in animal feed formulations. In the laboratory and life-science research, hydroxocobalamin serves as a cobalt-containing cofactor source for enzymatic systems related to B12 metabolism and as a tool in microbial culture work. In some markets, the compound is added to certain foods as a vitamin B12 ingredient, and it is considered in product development for nutrition-focused applications. Therefore, hydroxocobalamin plays a notable role across pharma, nutrition, food fortification, and research laboratories.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	15.27
methanol	90.32
isopropanol	4.31
water	1.82
ethyl acetate	5.75
n-propanol	7.41
acetone	22.11
n-butanol	3.25
acetonitrile	14.62
DMF	303.46
toluene	0.34
isobutanol	2.66
1,4-dioxane	18.19
methyl acetate	14.76
THF	41.91
2-butanone	11.35
n-pentanol	2.55
sec-butanol	2.42
n-hexane	0.05
ethylene glycol	31.56
NMP	209.92
cyclohexane	0.05
DMSO	146.22
n-butyl acetate	3.73
n-octanol	1.28
chloroform	25.79
n-propyl acetate	5.82
acetic acid	171.59
dichloromethane	22.11
cyclohexanone	11.49
propylene glycol	26.9
isopropyl acetate	2.38
DMAc	148.85
2-ethoxyethanol	34.53
isopentanol	1.52
n-heptane	0.04
ethyl formate	21.72
1,2-dichloroethane	7.84
n-hexanol	1.49
2-methoxyethanol	100.4
isobutyl acetate	2.46
tetrachloromethane	1.75
n-pentyl acetate	4.37
transcutol	28.0
n-heptanol	1.78
ethylbenzene	0.22
MIBK	1.74
2-propoxyethanol	28.57
tert-butanol	1.96
MTBE	0.76
2-butoxyethanol	19.32
propionic acid	23.88
o-xylene	0.2
formic acid	334.34
diethyl ether	1.57
m-xylene	0.17
p-xylene	0.42
chlorobenzene	1.5
dimethyl carbonate	26.87
n-octane	0.03
formamide	231.37
cyclopentanone	42.28
2-pentanone	4.91
anisole	1.78
cyclopentyl methyl ether	2.66
gamma-butyrolactone	96.04
1-methoxy-2-propanol	37.43
pyridine	17.1
3-pentanone	3.7
furfural	112.2
n-dodecane	0.03
diethylene glycol	50.89
diisopropyl ether	0.17
tert-amyl alcohol	1.42
acetylacetone	13.76
n-hexadecane	0.03
acetophenone	4.45
methyl propionate	11.34
isopentyl acetate	2.36
trichloroethylene	31.21
n-nonanol	1.29
cyclohexanol	1.28
benzyl alcohol	4.3
2-ethylhexanol	0.58
isooctanol	1.05
dipropyl ether	1.24
1,2-dichlorobenzene	1.9
ethyl lactate	11.09
propylene carbonate	35.22
n-methylformamide	154.67
2-pentanol	0.93
n-pentane	0.04
1-propoxy-2-propanol	12.04
1-methoxy-2-propyl acetate	8.11
2-(2-methoxypropoxy) propanol	10.36
mesitylene	0.08
ε-caprolactone	16.32
p-cymene	0.16
epichlorohydrin	54.33
1,1,1-trichloroethane	4.08
2-aminoethanol	31.36
morpholine-4-carbaldehyde	148.51
sulfolane	122.06
2,2,4-trimethylpentane	0.01
2-methyltetrahydrofuran	6.61
n-hexyl acetate	3.71
isooctane	0.01
2-(2-butoxyethoxy)ethanol	16.38
sec-butyl acetate	1.83
tert-butyl acetate	1.6
decalin	0.02
glycerin	87.03
diglyme	32.85
acrylic acid	52.69
isopropyl myristate	0.8
n-butyric acid	15.09
acetyl acetate	7.17
di(2-ethylhexyl) phthalate	2.69
ethyl propionate	4.23
nitromethane	299.38
1,2-diethoxyethane	3.96
benzonitrile	4.8
trioctyl phosphate	1.59
1-bromopropane	1.37
gamma-valerolactone	147.7
n-decanol	0.82
triethyl phosphate	1.98
4-methyl-2-pentanol	0.43
propionitrile	6.01
vinylene carbonate	45.85
1,1,2-trichlorotrifluoroethane	111.89
DMS	7.0
cumene	0.15
2-octanol	0.82
2-hexanone	4.4
octyl acetate	1.69
limonene	0.19
1,2-dimethoxyethane	34.33
ethyl orthosilicate	1.43
tributyl phosphate	1.79
diacetone alcohol	6.51
N,N-dimethylaniline	1.33
acrylonitrile	19.64
aniline	1.95
1,3-propanediol	29.91
bromobenzene	1.17
dibromomethane	6.69
1,1,2,2-tetrachloroethane	21.3
2-methyl-cyclohexyl acetate	2.06
tetrabutyl urea	3.43
diisobutyl methanol	0.24
2-phenylethanol	3.48
styrene	0.33
dioctyl adipate	2.18
dimethyl sulfate	55.47
ethyl butyrate	2.78
methyl lactate	33.78
butyl lactate	9.66
diethyl carbonate	2.74
propanediol butyl ether	21.32
triethyl orthoformate	2.62
p-tert-butyltoluene	0.13
methyl 4-tert-butylbenzoate	5.06
morpholine	26.57
tert-butylamine	0.45
n-dodecanol	0.49
dimethoxymethane	58.43
ethylene carbonate	24.66
cyrene	27.8
2-ethoxyethyl acetate	10.75
2-ethylhexyl acetate	1.67
1,2,4-trichlorobenzene	3.58
4-methylpyridine	7.29
dibutyl ether	0.8
2,6-dimethyl-4-heptanol	0.24
DEF	12.86
dimethyl isosorbide	18.84
tetrachloroethylene	11.93
eugenol	9.63
triacetin	8.89
span 80	9.01
1,4-butanediol	11.75
1,1-dichloroethane	4.96
2-methyl-1-pentanol	1.22
methyl formate	146.98
2-methyl-1-butanol	1.6
n-decane	0.05
butyronitrile	3.62
3,7-dimethyl-1-octanol	0.59
1-chlorooctane	0.3
1-chlorotetradecane	0.1
n-nonane	0.05
undecane	0.04
tert-butylcyclohexane	0.02
cyclooctane	0.01
cyclopentanol	4.76
tetrahydropyran	4.3
tert-amyl methyl ether	0.69
2,5,8-trioxanonane	17.52
1-hexene	0.24
2-isopropoxyethanol	11.55
2,2,2-trifluoroethanol	82.8
methyl butyrate	7.15

Scent© AI