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名称

1-苄基-2-(3-甲氧基-3-氧丙基)氮杂环丁烷-2-羧酸甲酯

英文名称

methyl 1-benzyl-2-(3-methoxy-3-oxopropyl)azetidine-2-carboxylate

货号

M173509-1g

包装规格

浓度

≥97%

储存温度

室温

运输条件

常规运输

CAS号

1353160-88-9

分子式

C16H21NO4

分子量

291.347 g/mol

EC号

PubChem SID: 488201782

PubChem编号

56849770

Isomeric SMILES

COC(=O)CCC1(CCN1CC2=CC=CC=C2)C(=O)OC

IIUPAC Name

methyl 1-benzyl-2-(3-methoxy-3-oxopropyl)azetidine-2-carboxylate

INCHI

1S/C16H21NO4/c1-20-14(18)8-9-16(15(19)21-2)10-11-17(16)12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3

InChi Key

DZSLDKBRWUVBRW-UHFFFAOYSA-N

Smiles

COC(=O)CCC1(CCN1CC2=CC=CC=C2)C(=O)OC

PubChem SID

488201782

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

291.147 Da

单同位素质量Monoisotopic Mass

291.147 Da

拓扑极表面积Topological Polar Surface Area

55.800 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

378

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.8

Reaxy-Rn

22018740

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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