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2-Methyl-1,4-butanediol

2-Methyl-1,4-butanediol structure

CAS No:
2938-98-9
Formula:
C5H12O2
Chemical Name:
2-Methyl-1,4-butanediol
Synonyms:
1,4-Butanediol,2-methyl-;2-Methyl-1,4-butanediol;NSC 91489;101978-85-2

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2-Methyl-1,4-butanediol Basic Attributes

Molecular Weight：

104.149

Exact Mass：

104.15

EC Number：

220-925-5

NSC Number：

91489

HScode：

2905399090

Characteristics

PSA：

40.5

XLogP3：

Density：

1.4497 g/cm³ @ Temp: 20 °C

Melting Point：

50.86°C (estimate)

Boiling Point：

126-127 °C

Flash Point：

98.9ºC

Refractive Index：

1.443

Vapor Pressure：

0.0392mmHg at 25°C

Safety Information

Precautionary statement(s)：

P264, P280, P305+P351+P338, P33, P313

Hazard Statements：

H319

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 58 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:104.15
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:104.083729621
Monoisotopic Mass:104.083729621
Topological Polar Surface Area:40.5
Heavy Atom Count:7
Complexity:37.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: chemical formula for carbon monoxide; k2o; isobutyl alcohol; barium oxide; ferric oxide; p4o10

Guide of 2-Methyl-1,4-butanediol

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-Methyl-1,4-butanediol

SDS

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