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化合物简介
ortho-Vanillin (2-Hydroxy-3-methoxybenzaldehyde) is an organic solid present in the extracts and essential oils of many plants. Its functional groups include aldehyde, ether and phenol. ortho-Vanillin, a compound of the formula C8H8O3, is distinctly different from its more prevalent isomer, vanillin. The \"ortho-\" prefix refers to the position of the compound’s hydroxyl moiety, which is found in the para-position in vanillin.
基本信息
CAS:148-53-8
中文别名:2-羟基-3-甲氧基苯甲醛;O-香草醛;3-甲氧基-2-羟基苯甲醛;3-甲氧基水杨醛;2-香草醛;邻香兰素;
英文别名:o-Vanillin;Benzaldehyde, 2-hydroxy-3-methoxy-;2-hydroxy-3-methoxybenzaldehyde;3-Methoxysalicylaldehyde;2-Hydroxy-3-methoxybenzaldehyde;
分子式:C8H8O3
分子量:152.147
精确质量:152.047
Psa:46.53
Logp:1.2133
中文别名:2-羟基-3-甲氧基苯甲醛;O-香草醛;3-甲氧基-2-羟基苯甲醛;3-甲氧基水杨醛;2-香草醛;邻香兰素;
英文别名:o-Vanillin;Benzaldehyde, 2-hydroxy-3-methoxy-;2-hydroxy-3-methoxybenzaldehyde;3-Methoxysalicylaldehyde;2-Hydroxy-3-methoxybenzaldehyde;
分子式:C8H8O3
分子量:152.147
精确质量:152.047
Psa:46.53
Logp:1.2133
编号系统
BRN号:471913
PubChem号:24890053
MDL号:MFCD00003322
EINECS号:205-715-3
RTECS号:CU6530000
PubChem号:24890053
MDL号:MFCD00003322
EINECS号:205-715-3
RTECS号:CU6530000
物化性质
外观与性状:纤维状的,淡黄色,结晶固体
密度:1.231 g/cm3
沸点:265-266°C(lit.)
熔点:40-42°C(lit.)
闪点:>230°F
折射率:1.5632 (45ºC)
水溶解性:slightly soluble
稳定性:Stable at room temperature in closed containers under normal storage and handling conditions.
储存条件:Keep container closed when not in use. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed.
蒸汽压:0.00556mmHg at 25°C
密度:1.231 g/cm3
沸点:265-266°C(lit.)
熔点:40-42°C(lit.)
闪点:>230°F
折射率:1.5632 (45ºC)
水溶解性:slightly soluble
稳定性:Stable at room temperature in closed containers under normal storage and handling conditions.
储存条件:Keep container closed when not in use. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed.
蒸汽压:0.00556mmHg at 25°C
安全信息
RTECS号:CU6530000
安全说明:S23-S36-S24/25
WGK Germany:3
危险类别码:R36/37/38
海关编码:29124900
危险品标志:Xi
安全说明:S23-S36-S24/25
WGK Germany:3
危险类别码:R36/37/38
海关编码:29124900
危险品标志:Xi
生产方法及用途
用途
用于制药及电镀等工业。
用于制药及电镀等工业。
合成路线
上游原料
下游产品
图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

13C NMR : in CDCl3

1H NMR : 90 MHz in CDCl3

Mass

IR : KBr disc

IR : nujol mull

SOLUTION (10% CCl4 FOR 5000-1330, 10% CS2 FOR 1330-625 CM-1)

gas
