名称和标识符别名信息物化性质安全信息国际标准相关数据生产方法和用途相关文献专业数据库参考参考资料化合物详情（旧版）相关分类相关产品

DL-3-氨基-n-丁酸 | 541-48-0

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中文名称： DL-3-氨基-n-丁酸

英文名称： rac 3-Aminobutyric Acid

CAS No.： 541-48-0

分子式： C₄H₉NO₂

分子量： 103.1198

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：DL-3-氨基-n-丁酸结构式

MSDS： DL-3-氨基-n-丁酸MSDS

PubChem CID： 10932

价格行情： DL-3-氨基-n-丁酸价格

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DL-3-氨基-n-丁酸的其他展现形式

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3-Amino-4-hydroxybutanoic acid

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名称和标识符

MDL	MFCD00008087
InChIKey	OQEBBZSWEGYTPG-UHFFFAOYSA-N
Inchi	1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)
SMILES	O([H])C(C([H])([H])C([H])(C([H])([H])[H])N([H])[H])=O
BRN	1720563

别名信息

- 中文别名 -

DL-3-氨基-n-丁酸
3-氨基丁酸
DL-3-Aminobutyric Acid DL-3-氨基丁酸
DL-3-氨基丁酸
(±)-3-氨基丁酸

β-氨基丁酸
DL-3-氨基-N-丁酸

- 英文别名 -

3-Aminobutanoic acid
AMINOBUTYRIC ACID, 3-(BETA-AMINOBUTYRIC ACID)(RG)
Butanoic acid, 3-amino-
DL-3-Abu-OH
DL-3-AMINOBUTYRIC ACID

rac 3-Aminobutyric Acid
DL-beta-Aminobutyric acid
NSC 77380
3-Aminobutyric acid
beta-Aminobutyric acid
DL-3-AMINO-N-BUTYRIC ACID
BABA
3-amino-butyric acid
3-methyl-beta-alanine
3-Amino-Butanoic acid
Butyric acid, 3-amino-
DL-.beta.-Aminobutyric acid
dl-beta-Amino-n-butyric acid
OQEBBZSWEGYTPG-UHFFFAOYSA-N
3-aminobutyrate
DL-beta-homo-alanine
DL-3-aminobutanoic acid
DL-3-Ab
DL-3-Aminobutyric acid
CHEMBL1995111
3-Aminobutanoic acid, 97%
Q3604567
167222-96-0
H-beta-HoAla-OH.HCl
3-METHYL-.BETA.-ALANINE
3-Amino-(.+-.)-Butanoic acid
J-800369
AKOS005174346
541-48-0
(+/-)-3-aminobutanoic acid
DTXSID4040975
DL-Beta-Aminobutyric Acid DL-3-Aminobutyric Acid
(+/-)-3-Aminobutyric acid
FT-0689095
b-Homoalanine
Carbocreatine
Butanoic acid, 3-amino-, (A+/-)-
.BETA.-AMINOBUTYRIC ACID [MI]
4-amino-5-(2-methoxyphenyl)-2H-1,2,4-triazole-3-thione
(.+-.)-.beta.-Aminobutyric acid
3-Amino-DL-Butyric acid
A829994
2835-82-7
NS00083648
DL-.beta.-Aminobutyrate
Butyric acid, (.+-.)-
CS-W009549
FT-0650754
(RS)-3-AMINOBUTANOIC ACID
3-Amino-(.+-.)-Butyric acid
SY022577
MLS000069399
(+/-)-.BETA.-AMINOBUTYRIC ACID
SMR000058404
(+)-DimEt 2,3-O-isopropylideneD-tartrate
Tungsten(vi)oxychloride
NCI60_041705
(+/-)-3-AMINO-N-BUTYRIC ACID
NSC77380
.beta.-Aminobutanoic acid
3-Aminobutanoic acid, Vetec(TM) reagent grade, 97%
60625-83-4
AB87426
R-3-Aminobutyric acid
AM20100428
J-640366
dl-3-Aminobutyric
dl-.beta.-Amino-n-butyric acid
CHEBI:37081
MFCD00008087
Butyric acid, 3-amino-, DL-
SCHEMBL44574
SY022578
(3R)-3-Amino-butanoic acid
EINECS 220-617-0
0B9FE31A-1286-4B2B-B64E-4A3871898B12
J-502211
.BETA.-AMINOBUTYRIC ACID, (+/-)-
AB87563
NSC-77380
(3S)-3-Amino-butanoic acid
AS-11703
UNII-4282SA5CTS
FT-0650753
.beta.-Amino-n-butyric acid
A-5230
A5389
NS00032974
4282SA5CTS
EN300-23041
AI3-26821
.beta.-Aminobutyric acid
A0281
H-DL-Abu(3)-OH
EINECS 208-783-2
Z147647144
.beta.-Methyl-.beta.-alanine
FT-0625401
BUTYRIC ACID, .BETA.-AMINO-
3-aminopent-4-ynoic acid
HY-W008833
SY019803
Dolutegravir Intermediates

物化性质

实验特性

LogP	0.50860
PSA	63.32000
Merck	429
水溶性	almost transparency
沸点	223.6±23.0 ºC (760 Torr),
熔点	189 °C (dec.) (lit.)
闪点	89.0±22.6 ºC,
溶解度	易溶 (348 g/L) (25 ºC),
颜色与性状	未确定
溶解性	未确定
密度	1.105±0.06 g/cm3 (20 ºC 760 Torr),

计算特性

精确分子量	103.06300
氢键供体数量	2
氢键受体数量	3
可旋转化学键数量	2
同位素质量	103.063329
重原子数量	7
复杂度	72.1
同位素原子数量	0
确定原子立构中心数量	0
不确定原子立构中心数量	1
确定化学键立构中心数量	0
不确定化学键立构中心数量	0
共价键单元数量	1
疏水参数计算参考值（XlogP）	-3.1
互变异构体数量	无
表面电荷	0
拓扑分子极性表面积	63.3

安全信息

符号：	GHS07
RTECS号	EK7713333
WGK Germany	3
安全说明	S26
风险术语	R36/37/38
危险品标志	Xi
危险品运输编号	NONH for all modes of transport
危害声明	H315-H319-H335
警示性声明	P261-P305+P351+P338
储存条件	Store at room temperature
危险类别码	36/37/38
信号词	Warning

国际标准相关数据

EINECS	220-617-0

生产方法和用途

用途	暂无

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9. Synthesis of β-amino-acid peptides. Part 3. Preparation of racemic and chiral 3-aminobutyric acid derivatives and peptides using dihydro-oxazin-6-ones and conventional coupling reagents
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专业数据库参考

PubChemId	10932

参考资料

Reaxys RN	1720563
Beilstein	1720563

化合物详情（旧版）

SMILES

CC(N)CC(O)=O

DL-3-氨基-n-丁酸 | 541-48-0

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