기본 정보
- CAS
179324-86-8- 표준 SMILES
CC(C)C[C@H](N)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1- InChIKey
YYXCDWMJTBCHJW-AIUMHDJVSA-N- 분자식
- C15H28BNO2
- 평균 분자량
- 265.2 g/mol
- 단동위원소 질량
- 265.2213093
이름 및 식별자
- 우선 이름
- (R)-3-Methyl-1-((3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)butan-1-amine
- IUPAC
- (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butan-1-amine
- 현지명
- 4,6-메타노-1,3,2-벤조디옥사보롤-2-메탄아민
- 영어명
- 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine
- 분자식
- C15H28BNO2
- 분자량
- 265.2
이름 및 동의어
179324-86-8(R)-3-Methyl-1-((3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)butan-1-amine(R)-BoroLeu-(+)-Pinanediol(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butan-1-amine7MXZ4WDX32YYXCDWMJTBCHJW-AIUMHDJVSA-NI10293(1R)-3-methyl-1-[(3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-4,6-methano-1,3,2-benzodioxaborol-2-yl]butan-1-amine(alphaR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,5,5-trimethyl-alpha-(2-methylpropyl)-, (alphaR,3aS,4S,6S,7aR)-4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-, (alphaR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine, (alphaR,3aS,4S,6S,7aR)-
이름 더 보기
4,6-메타노-1,3,2-벤조디옥사보롤-2-메탄아민Bortezomib Impurity 804,6-Methano-1,3,2-benzodioxaborole-2-methanamine4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-(alphaR,3aS,4S,6S,7aR)-Hexahydro-3a,5,5-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine
데이터베이스 식별자
- CAS
179324-86-8- PubChem CID
- 44244714
- UNII
- 7MXZ4WDX32
물성
구조 계산 물성
- 극성 표면적
- 44.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 373
물리화학적 성질
- 끓는 점
- 316.6 · 316.6±25.0 °C(Predicted)
- 밀도
- 1.01 · 1.01±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 10.94 · 10.94±0.42(Predicted)
화학 및 산업
공급사15 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
武汉卓元易创科技有限公司13476791851 13476791851 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
广州康瑞泰药业有限公司020-82185713,82185709 13418171485 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
武汉宏信康精细化工有限公司027-59362599 18674037007 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
深圳瑞恺德生物科技有限公司0755-61348847 17820674378 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
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