CAS 13635-04-6|3-Hydroxy-3-methylbutanenitrile

Introduction：Basic information about CAS 13635-04-6|3-Hydroxy-3-methylbutanenitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Safety Information
4. Customs
5. Articles3
6. Synonyms

Common Name	3-Hydroxy-3-methylbutanenitrile
CAS Number	13635-04-6	Molecular Weight	99.131
Density	1.0±0.1 g/cm3	Boiling Point	217.2±13.0 °C at 760 mmHg
Molecular Formula	C₅H₉NO	Melting Point	/
MSDS	ChineseUSA	Flash Point	85.2±19.8 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	3-Hydroxy-3-methylbutanenitrile
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.0±0.1 g/cm3
Boiling Point	217.2±13.0 °C at 760 mmHg
Molecular Formula	C₅H₉NO
Molecular Weight	99.131
Flash Point	85.2±19.8 °C
Exact Mass	99.068413
PSA	44.02000
LogP	-0.24
Vapour Pressure	0.0±0.9 mmHg at 25°C
Index of Refraction	1.435
InChIKey	CWPMDJFBWQJRGT-UHFFFAOYSA-N
SMILES	CC(C)(O)CC#N

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302-H332
Personal Protective Equipment	Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xn: Harmful;
Risk Phrases	20/22
RIDADR	UN 3276 6.1/PG 3
HS Code	2926909090

Customs

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles3

Solid-phase chemical synthesis of phosphonoacetate and thiophosphonoacetate oligodeoxynucleotides.

J. Am. Chem. Soc. 125(4) , 940-50, (2003)

Phosphonoacetate and thiophosphonoacetate oligodeoxynucleotides were prepared via a solid-phase synthesis strategy. Under Reformatsky reaction conditions, novel esterified acetic acid phosphinodiamidi...

Theoretical study of the thermolysis reaction of β-hydroxynitriles in the gas phase. Chamorro E, et al.

Int. J. Quantum Chem. 91(5) , 618-625, (2003)

Elimination kinetics of β-hydroxynitriles in the gas phase. Chuchani G, et al.

J. Phys. Org. Chem. 12 , 19-23, (1999)

Synonyms

1,1-dimethyl-2-cyanoethanol

3,3-dimethyl-3-hydroxypropionitrile

Butanenitrile, 3-hydroxy-3-methyl-

3-hydroxy-3-methylbutyronitrile

3-Hydroxy-3-methylbutanenitrile

3-hydroxy-3-methylbutyronitril

2-cyano-1,1-dimethylethanol

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